SCHEMBL9529092

SCHEMBL9529092

CCCCc1nc(Cc2ccccc2Cl)c(C(C)C(Cc2ccccc2)C(=O)O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.35

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
SCHEMBL8954337 0.77 EPHX2 (0.38) PARP1
SCHEMBL28161278 0.75 PARP1 (0.41) PARP1
SCHEMBL9052148 0.74 PARP1 (0.40) PARP1
SCHEMBL9512926 0.73 HPGD (0.41) PARP1
SCHEMBL8954129 0.72
SCHEMBL9509544 0.71 APLNR (0.40) PARP1
Hydrochloric Acid SCHEMBL9267601 0.70 PARP1 (0.39) PARP1
SCHEMBL8741912 0.69 AGTR1 (0.36) PARP1
SCHEMBL7115521 0.69 AGTR1 (0.39)
SCHEMBL8741267 0.68 PARP1 (0.42) PARP1

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-0541705-A4 SUBSTITUTED 1H-IMIDAZOL-5-YL)ALKANOIC ACIDS 1993-11-10 EP claimed
EP-0541705-A1 SUBSTITUTED 1H-IMIDAZOL-5-YL]ALKANOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1993-05-19 EP claimed