SCHEMBL6965085

SCHEMBL6965085

COC(=O)C(Br)Cc1cnc2cc(OCc3nc(-c4ccccc4)oc3C)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.53
FFAR1 O14842 1/20 0.52
PPARG P37231 12/20 0.50
PPARA Q07869 10/20 0.50
MAPT P10636 4/20 0.47

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
SCHEMBL7157011 0.78 PPARG (0.72) PPARGPPARA
SCHEMBL6584575 0.78 FFAR1 (0.49) KDRFFAR1PPARGPPARAMAPT
SCHEMBL29691546 0.77 FFAR1 (0.70) FFAR1PPARGPPARAMAPT
SCHEMBL6963034 0.77 KDR (0.57) KDRFFAR1PPARGPPARAMAPT
SCHEMBL7559600 0.76 KDR (0.83) KDRFFAR1PPARGPPARAMAPT
SCHEMBL6971980 0.76 FFAR1 (0.47) KDRFFAR1PPARGPPARAMAPT
SCHEMBL8126485 0.76 PPARG (0.74) PPARGPPARA
SCHEMBL6960726 0.76 KDR (0.50) KDRFFAR1PPARGPPARA
SCHEMBL6960411 0.76 MAOB (0.45)
SCHEMBL6967037 0.75 KDR (0.53) KDRFFAR1PPARGPPARAMAPT

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-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed