SCHEMBL7428787

SCHEMBL7428787

O=C(O)CN1CC(=O)N(C(CS)Cc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CPA3 P15088 1/20 0.43
FOLH1 Q04609 1/20 0.43
ENPP2 Q13822 1/20 0.42
ALDH1A1 P00352 3/20 0.42
PKM P14618 1/20 0.42
MME P08473 7/20 0.41
ACE P12821 6/20 0.41
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
ECE1 P42892 1/20 0.40
BLM P54132 1/20 0.40
NPEPPS P55786 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
SCHEMBL7426519 0.88 MME (0.42) KMT2ACPA3FOLH1ENPP2ALDH1A1
SCHEMBL7435994 0.85 MME (0.41) KMT2ACPA3FOLH1ENPP2ALDH1A1
SCHEMBL7432640 0.85 ENPP2 (0.47) KMT2APOLBCYP2D6CYP2C9CYP2C19
SCHEMBL7428452 0.84 PLA2G10 (0.45) CPA3FOLH1ENPP2ALDH1A1PKM
SCHEMBL7445692 0.81 ENPP2 (0.36) KMT2APOLBCPA3FOLH1ENPP2
SCHEMBL7442303 0.79 ALDH1A1 (0.53) KMT2APOLBCYP2C9CYP2C19CPA3
SCHEMBL7446522 0.78 CPA3 (0.44) CPA3FOLH1ALDH1A1PKMMME
SCHEMBL7440464 0.78 FOLH1 (0.41) KMT2ACPA3FOLH1ALDH1A1PKM
SCHEMBL7438154 0.77 ENPP2 (0.39) KMT2APOLBCYP2D6CYP2C9CYP2C19
SCHEMBL7428792 0.77 CYP2D6 (0.45) KMT2APOLBCYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed