SCHEMBL9007264

SCHEMBL9007264

CCc1cc2c(cc1/C(C)=C/c1ccc(C(=O)O)cc1)C(C)(C)CCC2(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 15/20 1.00
RARG P13631 15/20 1.00
RXRA P19793 14/20 1.00
RARA P10276 12/20 1.00
RXRB P28702 3/20 1.00
RXRG P48443 3/20 1.00
KDM4E B2RXH2 1/20 0.67
NPC1 O15118 1/20 0.67
CYP26A1 O43174 1/20 0.67
GMNN O75496 1/20 0.67
USP2 O75604 1/20 0.67
ALDH1A1 P00352 1/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
CYP1A2 P05177 1/20 0.67
POLB P06746 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
NFKB1 P19838 1/20 0.67
CYP2C19 P33261 1/20 0.67

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
SCHEMBL9007266 1.00 RARB (1.00) RARBRARGRXRARARARXRB
SCHEMBL9007272 1.00 RARB (1.00) RARBRARGRXRARARARXRB
SCHEMBL10847232 0.93 RARB (0.86) RARBRARGRXRARARARXRB
SCHEMBL10847236 0.93 RARB (0.86) RARBRARGRXRARARARXRB
SCHEMBL2890394 0.92 RARB (0.85) RARBRARGRXRARARARXRB
SCHEMBL2890391 0.92 RARB (0.85) RARBRARGRXRARARARXRB
4-Aminophenol SCHEMBL10852022 0.91 RXRA (0.82) RARBRARGRXRARARARXRB
4-Aminophenol SCHEMBL10852031 0.91 RXRA (0.82) RARBRARGRXRARARARXRB
SCHEMBL10841254 0.90 RXRA (0.81) RARBRARGRXRARARARXRB
SCHEMBL10843201 0.90 RXRA (0.81) RARBRARGRXRARARARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5534261-A Retinoid-based compositions and method for preventing adhesion formation using the same UNIVERSITY OF SOUTHERN CALIFORNIA (US) 1996-07-09 US disclosed
US-4578498-A FOR SKIN DISORDERS; REDUCED TOXICITY BASF AKTIENGESELLSCHAFT (DE) 1986-03-25 US disclosed