SCHEMBL7901979

SCHEMBL7901979

CCc1ccc2c(c1)CC(=O)N(CC(=O)O)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 6/20 0.55
▸ ITGA2B P08514 6/20 0.55
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ITGA2 P17301 1/20 0.35
▸ MEN1 O00255 2/20 0.35

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
SCHEMBL7895782 0.88 ITGB3 (0.48) ITGB3ITGA2BLMNAKDM4ETSHR
SCHEMBL17244439 0.83 ITGB3 (0.51) ITGB3ITGA2BLMNAKDM4EALOX15
SCHEMBL7895593 0.82 ITGB3 (0.38) ITGB3ITGA2BKDM4ETSHRALDH1A1
SCHEMBL12545824 0.80 ITGB3 (0.48) ITGB3ITGA2BKDM4EALOX15TSHR
SCHEMBL38662990 0.77 KDM4E (0.54) ITGB3ITGA2BKDM4EALOX15TSHR
SCHEMBL17244437 0.70 ITGB3 (0.45) ITGB3ITGA2BKDM4ETSHRALDH1A1
SCHEMBL12870511 0.68 PRMT5 (0.38) ITGB3ITGA2BALOX15CYP3A4KMT2A
SCHEMBL12545649 0.68 ITGB3 (0.43) ITGB3ITGA2BLMNATSHRCYP3A4
SCHEMBL21481250 0.67 HTR2A (0.46) ITGB3ITGA2BLMNAKDM4EALOX15
SCHEMBL7931439 0.67 KDM4E (0.45) KDM4EALOX15TSHRSIRT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 — — EP disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 — — WO disclosed
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