SCHEMBL8347443

SCHEMBL8347443

CCCCCCCCC(O)O/N=C(/C(=O)Nc1ccccc1C(=O)O)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 6/20 0.46
RXRA P19793 8/20 0.44
HNF4A P41235 4/20 0.44
RXRB P28702 4/20 0.43
RXRG P48443 4/20 0.43
PLK3 Q9H4B4 3/20 0.41
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
CYP26A1 O43174 3/20 0.39
CYP3A4 P08684 3/20 0.39
RARB P10826 3/20 0.39
RARG P13631 3/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
RARA P10276 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL8347100 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8345600 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8347040 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8353212 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8345697 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8349942 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8352417 1.00 PLK1 (0.46) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8347370 0.99 PLK1 (0.44) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8347051 0.90 RXRA (0.41) PLK1RXRAHNF4ARXRBRXRG
SCHEMBL8347392 0.90 RXRA (0.41) PLK1RXRAHNF4ARXRBRXRG

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
US-5935585-A Biaromatic amido compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-08-10 US claimed
US-5935585-A Biaromatic amido compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-08-10 US disclosed