SCHEMBL2746570

SCHEMBL2746570

COc1cc(CO)cnc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.54
POLB P06746 1/20 0.54
RAB9A P51151 1/20 0.54
CHRNB2 P17787 3/20 0.39
CHRNA4 P43681 3/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
FYN P06241 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
DPP4 P27487 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL22641245 0.83 PTGS2 (0.48) NPC1POLBRAB9ACHRNB2CHRNA4
SCHEMBL2746304 0.83 NPC1 (0.44) NPC1POLBRAB9ACHRNB2CHRNA4
SCHEMBL27677964 0.81 NPC1 (0.40) NPC1POLBRAB9ACHRNB2CHRNA4
SCHEMBL16246672 0.81 NPC1 (0.40) NPC1POLBRAB9ACHRNB2CHRNA4
SCHEMBL26992430 0.80 GAA (0.51) NPC1POLBRAB9AHSD17B10ALOX15
SCHEMBL21499282 0.79 NPC1 (0.48) NPC1POLBRAB9AHSD17B10ALOX15
SCHEMBL19330511 0.79 NPC1 (0.48) NPC1POLBRAB9AHSD17B10ALOX15
SCHEMBL2746674 0.79 MAPT (0.40) NPC1POLBRAB9ACHRNB2CHRNA4
SCHEMBL10112979 0.78 NPC1 (0.47) NPC1POLBRAB9AHSD17B10ALOX15
SCHEMBL24798987 0.77 NPC1 (0.38) NPC1POLBRAB9ACHRNB2CHRNA4

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
EP-3305778-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-19 EP disclosed
CN-105452240-B Hete rocyclic derivatives 卡尔维斯塔制药有限公司 2018-06-26 CN 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
WO-2016083816-A1 N-((HETEROARYLMETHYL)-HETEROARYL-CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-06-02 WO 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
CN-105452240-A Heterocyclic derivates KALVISTA PHARMACEUTICALS LTD 2016-03-30 CN disclosed
WO-2014188211-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-11-27 WO disclosed
US-7709649-B2 Multi-substituted pyridyl sulfoximines and their use as insecticides DOW AGROSCIENCES LLC (US) 2010-05-04 US disclosed
US-7709649-B2 Multi-substituted pyridyl sulfoximines and their use as insecticides DOW AGROSCIENCES LLC (US) 2010-05-04 US disclosed
US-7709649-B2 Multi-substituted pyridyl sulfoximines and their use as insecticides DOW AGROSCIENCES LLC (US) 2010-05-04 US disclosed
CN-101535263-A Polysubstituted pyridyl sulfoximines and their use as pesticides DOW AGROSCIENCES LLC (US) 2009-09-16 CN disclosed
EP-2079697-A1 MULTI-SUBSTITUTED PYRIDYL SULFOXIMINES AND THEIR USE AS INSECTICIDES Dow AgroSciences LLC (US) 2009-07-22 EP disclosed
WO-2008057129-A1 MULTI-SUBSTITUTED PYRIDYL SULFOXIMINES AND THEIR USE AS INSECTICIDES DOW AGROSCIENCES LLC (US) 2008-05-15 WO disclosed
WO-2008057129-A1 MULTI-SUBSTITUTED PYRIDYL SULFOXIMINES AND THEIR USE AS INSECTICIDES DOW AGROSCIENCES LLC (US) 2008-05-15 WO disclosed
US-20080108667-A1 Multi-substituted pyridyl sulfoximines and their use as insecticides CORTEVA AGRISCIENCE LLC 2008-05-08 US disclosed
US-20080108667-A1 Multi-substituted pyridyl sulfoximines and their use as insecticides CORTEVA AGRISCIENCE LLC 2008-05-08 US disclosed
US-20080108667-A1 Multi-substituted pyridyl sulfoximines and their use as insecticides CORTEVA AGRISCIENCE LLC 2008-05-08 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 (2 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-20080108667-A1 Multi-substituted pyridyl sulfoximines and their use as insecticides PIR, PNPO, PRDX4 NPC1 4881/4885POLB 3365/4885RAB9A 2655/4885
US-20160108036-A1 HETEROCYCLIC DERIVATES BDKRB1, KLKB1, BDKRB2 NPC1 1620/4885POLB 3416/4885RAB9A 1461/4885

“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.