SCHEMBL21201593

SCHEMBL21201593

Cc1ccc(Cn2ccc(C)cc2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.61
TP53 P04637 2/20 0.61
POLB P06746 3/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
THRB P10828 2/20 0.45
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
MAPK14 Q16539 1/20 0.44
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
GAA P10253 1/20 0.43
ADORA2A P29274 1/20 0.42

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
SCHEMBL21419979 0.89 MAPT (0.49) MAPTTP53POLBMEN1KMT2A
SCHEMBL29348734 0.88 ACHE (0.48) MAPTTP53POLBKMT2AMAPK14
SCHEMBL1346298 0.87 MAPK14 (0.58) MAPTTP53POLBMEN1KMT2A
SCHEMBL25852695 0.85 MAPT (0.43) MAPTTP53POLBMEN1KMT2A
SCHEMBL21201592 0.85 MAPT (0.45) MAPTTP53POLBHTTMAPK14
SCHEMBL21419948 0.84 MAPT (0.56) MAPTTP53POLBMEN1KMT2A
SCHEMBL25852518 0.84 MAPT (0.43) MAPTTP53POLBHTTMAPK14
SCHEMBL4280056 0.84 MAPT (0.43) MAPTTP53POLBMEN1KMT2A
SCHEMBL3702168 0.84 KLKB1 (0.44) MAPTTP53POLBMEN1KMT2A
SCHEMBL2552042 0.84 MAPT (0.44) MAPTTP53POLBMEN1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024050825-A1 COMPOUNDS AS MLKL INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2024-03-14 WO disclosed
EP-3556752-B1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-05 EP disclosed
US-11001578-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-05-11 US disclosed
US-20190330200-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS KALLIKREIN INHIBITORS DRI UK LP (KY) 2019-10-31 US disclosed
EP-3556752-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS PLASMA KALLIKREIN INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2019-10-23 EP disclosed
US-20190300517-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Plasma Kallikrein Inhibitors DRI UK LP (KY) 2019-10-03 US disclosed
US-10364238-B2 N-((het) arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2019-07-30 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 (4 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-10364238-B2 N-((het) arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 MAPT 4587/4885TP53 4766/4885POLB 4140/4885
US-20190300517-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Plasma Kallikrein Inhibitors KLKB1, BDKRB1, BDKRB2 MAPT 4603/4885TP53 4771/4885POLB 3901/4885
US-20190330200-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS KALLIKREIN INHIBITORS KLKB1, BDKRB1, BDKRB2 MAPT 4726/4885TP53 4767/4885POLB 3726/4885
US-11001578-B2 N-((HET)arylmethyl)-heteroaryl-carboxamides compounds as plasma kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 MAPT 4603/4885TP53 4771/4885POLB 3901/4885

“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.