SCHEMBL8901428

SCHEMBL8901428

CC1(C)COC(c2ccc(-c3ccc4cc(O)ccc4c3)cc2)=N1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.50
ESR2 Q92731 5/20 0.50
KDM4E B2RXH2 1/20 0.45
ABL1 P00519 2/20 0.44
ABCB1 P08183 2/20 0.44
BCR P11274 2/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
HRH3 Q9Y5N1 3/20 0.43
CYP2D6 P10635 2/20 0.42
HSD17B1 P14061 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2B6 P20813 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B2 P37059 1/20 0.42
CYP17A1 P05093 2/20 0.42
CYP11B1 P15538 2/20 0.42

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
SCHEMBL2088974 0.85 KDM4E (0.51) ESR1ESR2KDM4ELMNAMAPT
SCHEMBL20410523 0.82 KDM4E (0.50) KDM4EABL1LMNAMAPTHTT
SCHEMBL8911222 0.81 KDM4E (0.43) KDM4EABL1LMNAMAPTHTT
SCHEMBL20409590 0.80 KDM4E (0.53) KDM4ELMNAMAPTHTTHRH3
SCHEMBL8901369 0.80 KDM4E (0.42) KDM4EABL1LMNAMAPTHTT
SCHEMBL2201352 0.80 ESR2 (0.52) ESR1ESR2KDM4EABL1LMNA
SCHEMBL471858 0.79 KDM4E (0.60) KDM4ELMNAMAPTHTTHRH3
SCHEMBL19379596 0.78 LMNA (0.44) KDM4ELMNAMAPTHTTHRH3
SCHEMBL19287365 0.78 KDM4E (0.43) ESR1KDM4ELMNAMAPTHTT
SCHEMBL8900361 0.77 HRH3 (0.43) KDM4EABL1LMNAMAPTHTT

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
US-5686586-A Polycyclic aromatic derivatives, process for preparing the same and pharmaceutical and cosmetic compositions containing the same CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1997-11-11 US disclosed
US-5602104-A SKIN DISORDERS, CONJUNCTIVE TISSUE DISORDERS, ANTITUMOR AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-02-11 US disclosed
US-5434180-A Skin disorders; retinoid activity; rheumatoid psoriasis; CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-07-18 US disclosed
US-5124473-A Skin disorders; antiinflammatory agents, antiallergens CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1992-06-23 US disclosed
EP-0210929-B1 AROMATIC POLYCYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL AND COSMETIC USE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1992-06-03 EP disclosed
EP-0210929-A2 Aromatic polycyclic derivatives, process for their preparation and their pharmaceutical and cosmetic use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1987-02-04 EP disclosed