SCHEMBL7219680

SCHEMBL7219680

COc1ccc(C=C(C)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 16/20 0.71
RARB P10826 14/20 0.71
RARA P10276 14/20 0.71
RXRA P19793 7/20 0.71
KDM4E B2RXH2 1/20 0.71
NPC1 O15118 1/20 0.71
CYP26A1 O43174 1/20 0.71
GMNN O75496 1/20 0.71
USP2 O75604 1/20 0.71
ALDH1A1 P00352 1/20 0.71
LMNA P02545 1/20 0.71
TP53 P04637 1/20 0.71
CYP1A2 P05177 1/20 0.71
POLB P06746 1/20 0.71
CYP3A4 P08684 1/20 0.71
CYP2D6 P10635 1/20 0.71
NFKB1 P19838 1/20 0.71
CYP2C19 P33261 1/20 0.71
THPO P40225 1/20 0.71
MTOR P42345 1/20 0.71

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
SCHEMBL7219676 1.00 RARG (0.71) RARGRARBRARARXRAKDM4E
SCHEMBL7219675 1.00 RARG (0.71) RARGRARBRARARXRAKDM4E
SCHEMBL9860852 0.92 RARB (0.60) RARGRARBRARARXRAKDM4E
SCHEMBL9860836 0.92 RARB (0.60) RARGRARBRARARXRAKDM4E
SCHEMBL9860689 0.92 RARB (0.71) RARGRARBRARARXRAKDM4E
SCHEMBL9860683 0.92 RARB (0.71) RARGRARBRARARXRAKDM4E
SCHEMBL10644468 0.91 RARG (0.67) RARGRARBRARARXRAKDM4E
SCHEMBL10644463 0.91 RARG (0.67) RARGRARBRARARXRAKDM4E
SCHEMBL10643544 0.89 RARB (0.59) RARGRARBRARARXRAKDM4E
SCHEMBL10643547 0.89 RARB (0.59) RARGRARBRARARXRAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232779-B1 VINYL PHENOL DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF Aktiengesellschaft (DE) 1988-10-12 EP claimed
US-4714786-A Vinylphenol derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1987-12-22 US claimed
EP-0232779-A1 Vinyl phenol derivatives, their preparation and their use BASF Aktiengesellschaft (DE) 1987-08-19 EP claimed
US-6627652-B1 Treatment of diseases or conditions of the type which are normally treated with retinoid-like compounds is disclosed, with pharmaceutical compositions containing an active compound which is a selective agonist of the RXR retinoid ALLERGAN, INC. 2003-09-30 US disclosed
US-6624188-B1 Administered to treat or prevent one or more of the diseases and conditions selected from the group consisting of dermatoses, atherosclerosis and restenosis resulting from neointimal hyperproliferation, non-malignant and ALLERGAN, INC. 2003-09-23 US disclosed
US-5475113-A Treatment of skin disorders, skin cancer ALLERGAN, INC. (US) 1995-12-12 US disclosed
US-5455265-A For mammals; skin disorders, cancer, inflammatory disease, cardiovascular diorders, autoimmune diseases and others ALLERGAN, INC. (US) 1995-10-03 US disclosed
US-5055622-A For treating neoplasms and dermatoses HOFFMANN-LA ROCHE INC. (US) 1991-10-08 US disclosed
US-5030765-A Skin disorders, anititumor agents HOFFMANN-LA ROCHE INC. (US) 1991-07-09 US disclosed
US-5001276-A Novel tetrahydronaphthalene and indane derivatives HOFFMANN-LA ROCHE INC. (US) 1991-03-19 US disclosed
US-4990703-A Novel tetrahydronaphthalene and indane derivatives HOFFMANN-LA ROCHE INC. (US) 1991-02-05 US disclosed
US-4935560-A ANTITUMOR AGENTS; SKIN DISORDERS HOFFMANN-LA ROCHE INC. (US) 1990-06-19 US disclosed
US-4870219-A NEOPLASMS, DERMATOSES HOFFMANN-LA ROCHE INC. (US) 1989-09-26 US disclosed
EP-0232779-B1 VINYL PHENOL DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF Aktiengesellschaft (DE) 1988-10-12 EP disclosed
US-4714786-A Vinylphenol derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1987-12-22 US disclosed
EP-0232779-A1 Vinyl phenol derivatives, their preparation and their use BASF Aktiengesellschaft (DE) 1987-08-19 EP disclosed