SCHEMBL9867919

SCHEMBL9867919

CC1(C)CCC(C)(C)c2cc(O)c(N)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.44
RARB P10826 7/20 0.41
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 3/20 0.39
GAA P10253 3/20 0.39
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP3A4 P08684 2/20 0.38
RARG P13631 7/20 0.37
RARA P10276 5/20 0.37
RXRB P28702 8/20 0.36
RXRG P48443 7/20 0.36
THRB P10828 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
SCHEMBL11583537 0.87 ALDH1A1 (0.39) RXRARARBALDH1A1KDM4EMEN1
SCHEMBL9867812 0.84 PTK2 (0.44) RXRARARBTP53ALOX15CYP3A4
SCHEMBL15347776 0.84 RXRA (0.50) RXRARARBTP53CYP1A2CYP3A4
SCHEMBL29850490 0.82 ALDH1A1 (0.36) RXRAALDH1A1KDM4EMEN1GAA
SCHEMBL14945765 0.82 ALDH1A1 (0.36) RXRAALDH1A1KDM4EMEN1GAA
SCHEMBL18088472 0.80 ALDH1A1 (0.35) RXRAALDH1A1KDM4EMEN1GAA
SCHEMBL14182660 0.79 ALOX15 (0.42) ALDH1A1KDM4EMEN1GAAMAPT
SCHEMBL14182648 0.79 ALOX15 (0.42) ALDH1A1KDM4EMEN1GAAMAPT
SCHEMBL6224470 0.76 RXRA (0.46) RXRARARBTP53CYP1A2ALDH1A1
SCHEMBL21440625 0.76 RXRA (0.38) RXRARARBTP53ALOX15CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0292348-B1 POLYCYCLIC HETEROCYCLIC DERIVATIVES, PROCES FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND VETERINARY MEDICINES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1990-09-19 EP claimed
EP-0292348-A1 Polycyclic heterocyclic derivatives, proces for their preparation and their use in human and veterinary medicines CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1988-11-23 EP claimed
US-RE33533-E Skin disorders CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1991-02-05 US disclosed
EP-0292348-B1 POLYCYCLIC HETEROCYCLIC DERIVATIVES, PROCES FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND VETERINARY MEDICINES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1990-09-19 EP disclosed
US-4874747-A DERMATOLOGY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1989-10-17 US disclosed
EP-0292348-A1 Polycyclic heterocyclic derivatives, proces for their preparation and their use in human and veterinary medicines CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1988-11-23 EP disclosed