SCHEMBL16103947

SCHEMBL16103947

CNNC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 3/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ POLB P06746 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ ATM Q13315 1/20 0.62
▸ PLEC Q15149 1/20 0.62
▸ CA1 P00915 16/20 0.56
▸ CA2 P00918 16/20 0.56
▸ CA9 Q16790 16/20 0.56
▸ CA12 O43570 7/20 0.54
▸ ALPL P05186 1/20 0.53
▸ ALPI P09923 1/20 0.53
▸ ALPG P10696 1/20 0.53
▸ CA14 Q9ULX7 3/20 0.50
▸ CA7 P43166 3/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ DNASE1L3 Q13609 1/20 0.46
▸ PRMT1 Q99873 1/20 0.46

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
SCHEMBL17833664 0.93 USP2 (0.64) USP2MEN1POLBKMT2AATM
SCHEMBL14510941 0.89 USP2 (0.59) USP2MEN1POLBKMT2AATM
SCHEMBL10035689 0.89 USP2 (0.59) USP2MEN1POLBKMT2AATM
SCHEMBL10031014 0.88 USP2 (0.60) USP2MEN1POLBKMT2AATM
SCHEMBL19817548 0.88 USP2 (0.60) USP2MEN1POLBKMT2AATM
SCHEMBL19958456 0.82 CA1 (0.54) USP2MEN1POLBKMT2AATM
SCHEMBL19705803 0.82 CA1 (0.54) USP2MEN1POLBKMT2AATM
SCHEMBL17833665 0.82 MEN1 (0.49) USP2MEN1POLBKMT2AATM
SCHEMBL19817547 0.81 CA1 (0.59) USP2MEN1POLBKMT2AATM
SCHEMBL26083798 0.81 CA1 (0.54) USP2MEN1POLBKMT2AATM

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
US-8841285-B2 Potent immunosuppressive agents, derivatives and uses THE TEXAS A&M UNIVERSITY SYSTEM (US) 2014-09-23 — — US disclosed
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