Sugi Predict

Sugi Predict / Compounds / SCHEMBL7951095

SCHEMBL7951095

SCHEMBL7951095

C=CC(c1ccc(N=C(Cl)C(F)(F)F)cc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 8/20 0.37
▸ RARG P13631 8/20 0.37
▸ RARA P10276 7/20 0.37
▸ RXRA P19793 6/20 0.37
▸ RXRB P28702 5/20 0.37
▸ CYP26A1 O43174 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP26B1 Q9NR63 1/20 0.33
▸ RXRG P48443 2/20 0.31

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
SCHEMBL7951094 1.00 RARB (0.37) RARBRARGRARARXRARXRB
SCHEMBL7922977 0.80 RXRA (0.36) RARBRARGRARARXRARXRB
SCHEMBL7922980 0.80 RXRA (0.36) RARBRARGRARARXRARXRB
SCHEMBL7923066 0.80 RXRA (0.36) RARBRARGRARARXRARXRB
SCHEMBL7922973 0.75 RARB (0.44) RARBRARGRARARXRARXRB
SCHEMBL7922809 0.73 RXRA (0.43) RARBRARGRARARXRARXRB
SCHEMBL7949336 0.72 RXRA (0.69) RARBRARGRARARXRARXRB
SCHEMBL7931062 0.70 RXRA (0.40) RARBRARGRARARXRARXRB
SCHEMBL7931972 0.68 RXRA (0.38) RARBRARGRARARXRARXRB
SCHEMBL7922989 0.68 ALDH1A1 (0.33) 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-6265423-B1 SKIN DISORDERS; ANTICANCER AGENTS CENTRE EUROPEEN DE BIOPROSPECTIVE-CEB (FR) 2001-07-24 — — US disclosed