SCHEMBL7425679

SCHEMBL7425679

COC(=O)c1ccc(NCCC2CCN(C(=O)OC(C)(C)C)CC2)nc1C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 15/20 0.46
▸ EED O75530 1/20 0.46
▸ RBBP4 Q09028 1/20 0.46
▸ SUZ12 Q15022 1/20 0.46
▸ EZH2 Q15910 1/20 0.46
▸ AEBP2 Q6ZN18 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.42
▸ FAAH O00519 1/20 0.42

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
SCHEMBL6585898 0.78 GPR119 (0.48) GPR119KDM4EPKM
SCHEMBL6583545 0.77 FAAH (0.50) GPR119KDM4EPKMFAAH
SCHEMBL6535858 0.75 GPR119 (0.57) GPR119KDM4EPKM
SCHEMBL1295322 0.75 GPR119 (0.61) GPR119
SCHEMBL1576096 0.74 GPR119 (0.64) GPR119ALDH1A1
SCHEMBL1296046 0.73 GPR119 (0.52) GPR119KDM4EALDH1A1FAAH
SCHEMBL2557716 0.73 EED (0.46) GPR119EEDRBBP4SUZ12EZH2
SCHEMBL22894973 0.73 GPR119 (0.54) GPR119FAAH
SCHEMBL15051411 0.72 GPR119 (0.45) GPR119KDM4EPKMFAAH
SCHEMBL6923662 0.72 KDM4E (0.48) GPR119KDM4EPKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5821241-A INHIBIT BINDING OF FIBRINOGEN TO BLOOD PLATELETS, INHIBIT AGGREGATION OF BLOOD PLATELETS, PREVENT OR TREAT THROMBUS OR EMBOLUS FORMATION MERCK & CO., INC. (US) 1998-10-13 — — US disclosed
EP-0684823-A4 FIBRINOGEN RECEPTOR ANTAGONISTS. MERCK & CO INC (US) 1997-07-09 — — EP disclosed
EP-0684823-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1995-12-06 — — EP disclosed
WO-1994018981-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-09-01 — — WO disclosed
Send feedback