SCHEMBL16246754

SCHEMBL16246754

CCOC(=O)c1cnn(Cc2ccc(Cn3cc(C)cn3)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 14/20 0.57
GRM2 Q14416 1/20 0.51
LMNA P02545 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL2821953 0.93 LMNA (0.54) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL1909166 0.92 GRM2 (0.53) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL28595790 0.90 ESR1 (0.55) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL3092869 0.89 HSD17B10 (0.51) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL554548 0.89 GRM2 (0.51) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL553801 0.89 GRM2 (0.53) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL30739239 0.88 GRM2 (0.50) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL30739426 0.88 GRM2 (0.50) KLKB1GRM2LMNANPC1ALDH1A1
SCHEMBL3093449 0.88 GRM2 (0.63) KLKB1GRM2LMNAALDH1A1
SCHEMBL553854 0.88 HSD17B10 (0.60) KLKB1GRM2LMNANPC1ALDH1A1

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
EP-3305778-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-19 EP disclosed
EP-3305778-A1 INHIBITORS OF PLASMA KALLIKREIN Kalvista Pharmaceuticals Limited (GB) 2018-04-11 EP disclosed
EP-2999697-B1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LTD (GB) 2017-04-19 EP disclosed
US-9533987-B2 Heterocyclic derivates KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-01-03 US disclosed
US-20160108036-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-04-21 US disclosed
EP-2999697-A1 HETEROCYCLIC DERIVATES Kalvista Pharmaceuticals Limited (GB) 2016-03-30 EP disclosed
WO-2014188211-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-11-27 WO 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 (1 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-20160108036-A1 HETEROCYCLIC DERIVATES BDKRB1, KLKB1, BDKRB2 KLKB1 2/4885GRM2 4059/4885LMNA 584/4885

“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.