SCHEMBL7224256

SCHEMBL7224256

CCOC(=O)c1ccc(/C=C(\C)c2cc3c(cc2C)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 17/20 0.72
RXRA P19793 16/20 0.72
RARG P13631 15/20 0.72
RARA P10276 10/20 0.72
RXRG P48443 8/20 0.72
RXRB P28702 7/20 0.72
KDM4E B2RXH2 1/20 0.52
NPC1 O15118 1/20 0.52
CYP26A1 O43174 1/20 0.52
GMNN O75496 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
TP53 P04637 1/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
NFKB1 P19838 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL7224258 1.00 RARB (0.72) RARBRXRARARGRARARXRG
SCHEMBL10841202 0.93 RARB (0.62) RARBRXRARARGRARARXRG
SCHEMBL10841205 0.93 RARB (0.62) RARBRXRARARGRARARXRG
SCHEMBL10843504 0.92 RXRA (0.68) RARBRXRARARGRARARXRG
SCHEMBL10843511 0.92 RXRA (0.68) RARBRXRARARGRARARXRG
SCHEMBL10841232 0.91 RXRA (0.67) RARBRXRARARGRARARXRG
SCHEMBL10841235 0.91 RXRA (0.67) RARBRXRARARGRARARXRG
SCHEMBL10842522 0.91 RARB (0.76) RARBRXRARARGRARARXRG
SCHEMBL10843123 0.91 RARB (0.76) RARBRXRARARGRARARXRG
SCHEMBL7224023 0.90 RARB (0.72) RARBRXRARARGRARARXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0688213-B1 TREATMENT OF TUMORS WITH COMPOUNDS HAVING RXR RETINOID RECEPTOR AGONIST ACTIVITY ALLERGAN INC (US) 2001-12-12 EP disclosed
EP-1159961-A2 Treatment of tumors with compounds having RxR retinoid receptor agonist activity ALLERGAN, INC. (US) 2001-12-05 EP disclosed
EP-0909560-A2 Treatment o tumors with compounds having RXR retinoid receptor agoinst activity ALLERGAN, INC. (US) 1999-04-21 EP 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-5399586-A Treatment of mammals afflicted with tumors with compounds having RXR retinoid receptor agonist activity ALLERGAN, INC. (US) 1995-03-21 US disclosed
US-5324840-A Skin disorders ALLERGAN, INC. (US) 1994-06-28 US disclosed
US-4578498-A FOR SKIN DISORDERS; REDUCED TOXICITY BASF AKTIENGESELLSCHAFT (DE) 1986-03-25 US disclosed