SCHEMBL4186323

SCHEMBL4186323

Cn1nc(C(F)(F)F)cc1-c1cccc2c(O)c(C(=O)C(N)C(=O)O)c(=O)oc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 6/20 0.35
ALOX5 P09917 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34

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
SCHEMBL28019091 0.85 HDAC3 (0.38) CARM1ALOX5PTGS1PTGS2HDAC3
SCHEMBL2761588 0.81 EGLN1 (0.44) EGLN2
SCHEMBL28019092 0.75 STIM1 (0.38) ALOX5PTGS1PTGS2HDAC3HDAC4
SCHEMBL2514434 0.73 PRMT5 (0.42) ALOX5PTGS1PTGS2HDAC3HDAC4
SCHEMBL2761892 0.68 EGLN1 (0.47) EGLN2STIM1ORAI1
SCHEMBL2471307 0.68 EGLN1 (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL4345184 0.66 STIM1 (0.35) ALOX5PTGS1PTGS2HDAC3HDAC4
SCHEMBL22787052 0.65 NOTUM (0.41) ALOX5PTGS1PTGS2HDAC3HDAC4
SCHEMBL24865069 0.65 ADORA3 (0.41) HDAC4HDAC2HDAC8HDAC6KDM4E
SCHEMBL10010119 0.63 KDM4E (0.46) KDM4E

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-2009100250-A1 CHROMENE DERIVATIVES AND USE THEREOF AS HIF HYDROXYLASE ACTIVITY INHIBITORS FIBROGEN, INC. (US) 2009-08-13 WO disclosed