SCHEMBL10733163

SCHEMBL10733163

COc1ccc(/C=C(\C)c2cc3c(cc2C)CCCC3(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 14/20 0.55
▸ RARB P10826 13/20 0.55
▸ RARG P13631 12/20 0.55
▸ RARA P10276 8/20 0.55
▸ RXRB P28702 7/20 0.55
▸ RXRG P48443 7/20 0.55
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ CYP26A1 O43174 1/20 0.40
▸ GMNN O75496 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ CYP2C19 P33261 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
SCHEMBL10648467 1.00 RXRA (0.55) RXRARARBRARGRARARXRB
SCHEMBL10734420 0.89 RXRA (0.58) RXRARARBRARGRARARXRB
SCHEMBL10645865 0.89 RXRA (0.58) RXRARARBRARGRARARXRB
SCHEMBL10643410 0.87 RXRA (0.55) RXRARARBRARGRARARXRB
SCHEMBL10844307 0.84 RARB (0.74) RXRARARBRARGRARARXRB
SCHEMBL10842818 0.84 RARB (0.74) RXRARARBRARGRARARXRB
SCHEMBL10851268 0.82 RARB (0.53) RXRARARBRARGRARARXRB
SCHEMBL10844543 0.82 RARB (0.55) RXRARARBRARGRARARXRB
SCHEMBL10844539 0.82 RARB (0.55) RXRARARBRARGRARARXRB
SCHEMBL10712505 0.81 RXRA (0.49) RXRARARBRARGRARARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4714786-A Vinylphenol derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1987-12-22 — — US disclosed
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