SCHEMBL8911146

SCHEMBL8911146

COP(=O)(CCc1ccc(N(CCO)C(=O)Nc2ccc(C#N)cc2)cc1)OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
PSMB5 P28074 1/20 0.39
CNR1 P21554 1/20 0.38
MCHR1 Q99705 4/20 0.38
LIMK1 P53667 2/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
RORC P51449 3/20 0.37
POLB P06746 3/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
IL18 Q14116 1/20 0.37

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
SCHEMBL8911262 0.87 SIRT2 (0.38) USP2HSD17B10SAE1UBA2PSMB5
SCHEMBL8912130 0.85 CYP11B1 (0.43) USP2HSD17B10SAE1UBA2PSMB5
SCHEMBL8912795 0.83 EPHX2 (0.41) USP2HSD17B10SAE1UBA2PSMB5
SCHEMBL8911515 0.79 CYP11B1 (0.41) USP2HSD17B10SAE1UBA2PSMB5
SCHEMBL8910427 0.77 HTT (0.40) USP2HSD17B10SAE1UBA2PSMB5
SCHEMBL8575317 0.77 LIMK1 (0.46) USP2HSD17B10PSMB5LIMK1POLB
SCHEMBL8912006 0.76 CA12 (0.43) USP2HSD17B10MCHR1LIMK1RORC
SCHEMBL8912007 0.76 CA12 (0.43) USP2HSD17B10MCHR1LIMK1RORC
SCHEMBL8910422 0.75 RORC (0.41) USP2HSD17B10SAE1UBA2MCHR1
SCHEMBL8574886 0.72 ALDH1A1 (0.41) USP2HSD17B10SAE1UBA2PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
US-5478942-A Antiinflammatory agents, antiagglomerants KARL THOMAE GMBH (DE) 1995-12-26 US disclosed
US-5276049-A Treatment of thrombosis DR. KARL THOMAE GMBH (DE) 1994-01-04 US disclosed