SCHEMBL7277181

SCHEMBL7277181

C=C(C)N1CCCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
MITF O75030 1/20 0.42
BRD4 O60885 1/20 0.38
BRD2 P25440 1/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
TP53 P04637 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
STAT6 P42226 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
SCHEMBL6822537 0.98 SMN1; SMN2 (0.45) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL195052 0.93
SCHEMBL8067929 0.82 LMNA (0.46) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL225584 0.80 SMN1; SMN2 (0.45) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL226372 0.80 SMN1; SMN2 (0.45) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL641600 0.80 LMNA (0.52) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL9635540 0.80 LMNA (0.41) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL15061902 0.78 SMN1; SMN2 (0.50) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL8379280 0.78 SMN1; SMN2 (0.50) LMNASMN1; SMN2MITFBRD4BRD2
SCHEMBL15061890 0.78 SMN1; SMN2 (0.50) LMNASMN1; SMN2MITFBRD4BRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0512831-B1 Fibrinogen receptor antagonists MERCK & CO INC (US) 1999-09-22 EP disclosed
US-5455243-A Anticoagulants MERCK & CO., INC. (US) 1995-10-03 US disclosed
CN-1067883-A FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1993-01-13 CN disclosed
WO-1992019595-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1992-11-12 WO disclosed
EP-0512831-A1 Fibrinogen receptor antagonists MERCK & CO. INC. (US) 1992-11-11 EP disclosed