SCHEMBL7368744

SCHEMBL7368744

CCCCOC(=O)NC(C)(N)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
ACHE P22303 12/20 0.43
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ATM Q13315 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40

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
SCHEMBL10476092 1.00 EPHX1 (0.44) EPHX1ACHEALDH1A1RAB9ANPC1
SCHEMBL1504663 0.85 EPHX1 (0.43) EPHX1ACHEALDH1A1RAB9ANPC1
SCHEMBL9030664 0.83 EPHX1 (0.42) EPHX1ACHEALDH1A1RAB9ANPC1
SCHEMBL2487393 0.82 EPHX1 (0.47) EPHX1ACHEALDH1A1POLBATM
SCHEMBL5201837 0.81 EPHX1 (0.43) EPHX1ACHEALDH1A1RAB9APOLB
SCHEMBL3400195 0.81 EPHX1 (0.43) EPHX1ACHEALDH1A1POLBATM
SCHEMBL2486965 0.81 EPHX1 (0.46) EPHX1ACHEALDH1A1POLBATM
SCHEMBL11525795 0.80 EPHX1 (0.48) EPHX1ACHEALDH1A1POLBATM
SCHEMBL11100479 0.80 EPHX1 (0.52) EPHX1ACHEALDH1A1RAB9ANPC1
SCHEMBL5492611 0.79 POLB (0.46) EPHX1ACHEALDH1A1POLBATM

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-1224186-A2 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION COR THERAPEUTICS, INC. (US) 2002-07-24 EP disclosed
WO-2001030780-A2 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION COR THERAPEUTICS, INC. (US) 2001-05-03 WO disclosed