SCHEMBL17540824

SCHEMBL17540824

Cc1cnn(Cc2ccc(C(C)C)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 10/20 0.46
ESRRG P62508 1/20 0.43
CACNA1H O95180 1/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
KLK1 P06870 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SCD O00767 1/20 0.40
SCD5 Q86SK9 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19513454 0.86 KLKB1 (0.43) KLKB1KMT2ALMNAMAPTKLK1
SCHEMBL16804397 0.85 CACNA1H (0.43) KLKB1CACNA1HHSD17B10TSHRMAPK1
SCHEMBL13813853 0.84 KCNH2 (0.53) KLKB1HSD17B10TSHRMAPK1KMT2A
SCHEMBL15759268 0.84 KLKB1 (0.51) KLKB1HSD17B10TSHRMAPK1KMT2A
SCHEMBL17229326 0.83 KLKB1 (0.46) KLKB1HSD17B10TSHRMAPK1KMT2A
SCHEMBL13102481 0.83 KLKB1 (0.54) KLKB1KMT2ALMNAMAPTKLK1
SCHEMBL13800892 0.81 KCNH2 (0.50) ESRRGHSD17B10TSHRMAPK1KMT2A
SCHEMBL17232474 0.81 KLKB1 (0.49) KLKB1HSD17B10TSHRMAPK1KMT2A
SCHEMBL16246747 0.81 KLKB1 (0.49) KLKB1HSD17B10TSHRMAPK1KMT2A
SCHEMBL16246934 0.80 KLKB1 (0.44) KLKB1HSD17B10KLK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153724-A1 Inhibitors Of Plasma Kallikrein KALVISTA PHARMACEUTICALS LTD (GB) 2022-05-19 US disclosed
US-11242333-B2 Inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-02-08 US disclosed
US-11198691-B2 N-((het)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-12-14 US disclosed
US-11084809-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-08-10 US disclosed
US-11001578-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-05-11 US disclosed
US-20200361923-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors DRI UK LP (KY) 2020-11-19 US disclosed
US-10781181-B2 N-((het) arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2020-09-22 US disclosed
US-20200199116-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors DRI UK LP (KY) 2020-06-25 US disclosed
US-20190330200-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS KALLIKREIN INHIBITORS DRI UK LP (KY) 2019-10-31 US disclosed
US-20190300517-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Plasma Kallikrein Inhibitors DRI UK LP (KY) 2019-10-03 US disclosed
US-9738641-B2 Bicyclic inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-08-22 US disclosed
US-9738641-B2 Bicyclic inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-08-22 US disclosed
US-9670157-B2 Benzylamine derivatives KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-06-06 US disclosed
US-9670157-B2 Benzylamine derivatives KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-06-06 US disclosed
US-9533987-B2 Heterocyclic derivates KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-01-03 US disclosed
US-20160185773-A1 BICYCLIC INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-06-30 US disclosed
US-20160168123-A1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-06-16 US disclosed
US-20160108036-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-04-21 US disclosed
US-20160039752-A1 BENZYLAMINE DERIVATIVES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-02-11 US disclosed
US-9029407-B2 Aminothiazole modulators of beta-3-adrenoreceptor AUSPEX PHARMACEUTICALS, INC. (US) 2015-05-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220153724-A1 Inhibitors Of Plasma Kallikrein KLKB1, SERPINB1, KLK5 KLKB1 1/4885ESRRG 1781/4885CACNA1H 4796/4885
US-11242333-B2 Inhibitors of plasma kallikrein KLKB1, SERPINB1, KLK5 KLKB1 1/4885ESRRG 1781/4885CACNA1H 4796/4885
US-20160185773-A1 BICYCLIC INHIBITORS KLKB1, SERPINB1, BDKRB1 KLKB1 1/4885ESRRG 3028/4885CACNA1H 4158/4885
US-20200199116-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1460/4885CACNA1H 4580/4885
US-20160168123-A1 INHIBITORS OF PLASMA KALLIKREIN KLKB1, SERPINB1, KLK5 KLKB1 1/4885ESRRG 1781/4885CACNA1H 4796/4885
US-11198691-B2 N-((het)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1460/4885CACNA1H 4580/4885
US-20160108036-A1 HETEROCYCLIC DERIVATES BDKRB1, KLKB1, BDKRB2 KLKB1 2/4885ESRRG 1190/4885CACNA1H 4764/4885
US-10781181-B2 N-((het) arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1355/4885CACNA1H 4424/4885
US-20190300517-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Plasma Kallikrein Inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1580/4885CACNA1H 4565/4885
US-20200361923-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1460/4885CACNA1H 4580/4885
US-20190330200-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS KALLIKREIN INHIBITORS KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1460/4885CACNA1H 4580/4885
US-11001578-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1580/4885CACNA1H 4565/4885
US-11084809-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 KLKB1 1/4885ESRRG 1460/4885CACNA1H 4580/4885
US-20160039752-A1 BENZYLAMINE DERIVATIVES BDKRB1, BDKRB2, KLKB1 KLKB1 3/4885ESRRG 2226/4885CACNA1H 3784/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.