SCHEMBL7274953

SCHEMBL7274953

C=CCC1(C(=O)OC)CCC(N)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 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
SCHEMBL15237366 0.85 CYP4F2 (0.35) CYP4F2CYP4A11
SCHEMBL2633835 0.83 KMT2A (0.35) CYP4F2CYP4A11
SCHEMBL2633836 0.83 RORC (0.33) CYP4F2CYP4A11
SCHEMBL25188768 0.81 CYP4F2 (0.50) CYP4F2CYP4A11
SCHEMBL24036211 0.80 KMT2A (0.33) CYP4F2CYP4A11
SCHEMBL34475417 0.80 MMP1 (0.34) CYP4F2CYP4A11
SCHEMBL6152526 0.80
SCHEMBL2633828 0.80 CYP4F2 (0.49) CYP4F2CYP4A11
SCHEMBL34476313 0.80 CYP4F2 (0.49) CYP4F2CYP4A11
SCHEMBL6063404 0.80 CYP2C19 (0.31)

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
US-5281585-A Secondary amide containing antagonist MERCK & CO., INC. (US) 1994-01-25 US 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