SCHEMBL2666139

SCHEMBL2666139

O=C(O)CSc1cnc(NC(=O)NC2CCCCC2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ MAPT P10636 8/20 0.46
▸ TP53 P04637 6/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ AURKA O14965 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ CCNE2 O96020 5/20 0.44
▸ CCNE1 P24864 5/20 0.44
▸ CDK2 P24941 5/20 0.44
▸ CCNB2 O95067 3/20 0.44

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
SCHEMBL21516509 0.82 CDK2 (0.45) CCNE2CCNE1CDK2CCNB2CDK1
SCHEMBL12384824 0.81 CCNE1 (0.41) MEN1KMT2AALDH1A1CCNE2CCNE1
SCHEMBL9072844 0.81 CCNE1 (0.62) RAB9AMEN1KMT2AALDH1A1NPC1
SCHEMBL9071847 0.80 CCNE2 (0.47) RAB9AALDH1A1NPC1POLBCCNE2
SCHEMBL999233 0.80 CCNE1 (0.43) RAB9AALDH1A1NPC1CCNE2CCNE1
SCHEMBL999125 0.80 CCNE1 (0.43) RAB9AALDH1A1NPC1CCNE2CCNE1
SCHEMBL998518 0.80 CCNE1 (0.43) RAB9AALDH1A1NPC1CCNE2CCNE1
SCHEMBL1000176 0.80 CCNE1 (0.43) RAB9AALDH1A1NPC1CCNE2CCNE1
SCHEMBL999286 0.80 CCNE1 (0.43) RAB9AALDH1A1NPC1CCNE2CCNE1
SCHEMBL2667657 0.79 CDK2 (0.46) RAB9AMEN1KMT2ANPC1POLB

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
WO-2005066145-A1 HETEROARYL-UREAS AND THEIR USE AS GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-07-21 — — WO disclosed
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