SCHEMBL22811326

SCHEMBL22811326

NS(=O)(=O)CCc1ccc(Cl)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ DAO P14920 1/20 0.37
▸ NFE2L2 Q16236 2/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA3 P07451 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA6 P23280 1/20 0.35
▸ CA5A P35218 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA13 Q8N1Q1 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35
▸ CA5B Q9Y2D0 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ MAOB P27338 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL4704270 0.84 APLNR (0.44) KDM4EDAONFE2L2POLBRAB9A
SCHEMBL4706111 0.82 KDM4E (0.38) KDM4EDAONFE2L2POLBMAOB
SCHEMBL21826791 0.81 KDM4E (0.44) KDM4EDAONFE2L2CA12CA1
SCHEMBL19550276 0.76 APLNR (0.47) KDM4ERECQLNFE2L2CA12CA1
SCHEMBL8337948 0.75 HRH1 (0.47) DAOMAOBPLAUADRA2AADRA2B
SCHEMBL31497358 0.75 HRH1 (0.47) DAOMAOBPLAUADRA2AADRA2B
SCHEMBL15769012 0.72 DAO (0.36) KDM4EDAOMAOBL3MBTL1PLAU
SCHEMBL19555391 0.72 KDM4E (0.45) KDM4EDAONFE2L2POLBMAOB
SCHEMBL8113789 0.71 RECQL (0.64) RECQLCA12CA1CA2CA3
SCHEMBL3553769 0.71 PTK2 (0.40) KDM4EPOLBRAB9AL3MBTL1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541803-B1 TRIAZOLE PYRIDYL COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-12-23 — — EP disclosed
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