SCHEMBL8555445

SCHEMBL8555445

CCCCCCON=C(C(=O)Nc1ccccc1C(=O)O)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.52
HNF4A P41235 2/20 0.52
PLK1 P53350 8/20 0.51
RXRG P48443 6/20 0.50
RXRB P28702 5/20 0.50
PLK3 Q9H4B4 3/20 0.43
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
RARB P10826 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
SCHEMBL8557640 1.00 RXRA (0.52) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8556422 1.00 RXRA (0.52) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8555502 1.00 RXRA (0.52) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8555708 0.93 RXRA (0.52) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8347443 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8352417 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8345697 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8347040 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8349942 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB
SCHEMBL8347100 0.88 PLK1 (0.46) RXRAHNF4APLK1RXRGRXRB

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-5709867-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-20 US claimed
US-5709867-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-20 US disclosed