SCHEMBL10841477

SCHEMBL10841477

Cc1cc2c(cc1/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 12/20 1.00
RARG P13631 12/20 1.00
RARA P10276 11/20 1.00
RXRA P19793 14/20 0.63
RXRB P28702 6/20 0.63
RXRG P48443 6/20 0.63
CYP26A1 O43174 2/20 0.58
RECQL P46063 2/20 0.58
BLM P54132 2/20 0.58
MEN1 O00255 1/20 0.58
ABCB11 O95342 1/20 0.58
ESR1 P03372 1/20 0.58
PGR P06401 1/20 0.58
HTR1A P08908 1/20 0.58
ADRA2A P08913 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
CHRM1 P11229 1/20 0.58
DRD1 P21728 1/20 0.58
TBXA2R P21731 1/20 0.58
SLC6A2 P23975 1/20 0.58

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
SCHEMBL156460 1.00 RARB (1.00) RARBRARGRARARXRARXRB
Hydrochloric Acid SCHEMBL4432609 0.99 RARB (0.97) RARBRARGRARARXRARXRB
4-Aminophenol SCHEMBL10844077 0.90 RARB (0.80) RARBRARGRARARXRARXRB
4-Aminophenol SCHEMBL10844066 0.90 RARB (0.80) RARBRARGRARARXRARXRB
SCHEMBL4450647 0.87 RARB (0.77) RARBRARGRARARXRARXRB
SCHEMBL4666956 0.87 RARB (0.77) RARBRARGRARARXRARXRB
SCHEMBL4666958 0.86 RARB (0.75) RARBRARGRARARXRARXRB
SCHEMBL2594345 0.86 RARB (0.75) RARBRARGRARARXRARXRB
SCHEMBL1072526 0.85 RARB (0.74) RARBRARGRARARXRARXRB
SCHEMBL4712935 0.85 RARB (0.74) RARBRARGRARARXRARXRB

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-4578498-A FOR SKIN DISORDERS; REDUCED TOXICITY BASF AKTIENGESELLSCHAFT (DE) 1986-03-25 US disclosed