SCHEMBL7548008

SCHEMBL7548008

CCc1cc(CCc2ccc(CC(=O)O)cc2)cc2c1OC(C)(C)CC2(C)C

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 14/20 0.59
CYP26B1 Q9NR63 12/20 0.59
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
RAB9A P51151 1/20 0.34
SSTR5 P35346 1/20 0.33

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
SCHEMBL7548002 0.84 CYP26A1 (0.42) CYP26A1CYP26B1ALDH1A1HSD17B10RAB9A
SCHEMBL5737183 0.83 CYP26A1 (0.56) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL14223679 0.75 CYP26A1 (0.54) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL6143586 0.75 CYP26A1 (0.53) CYP26A1CYP26B1HPGDHSD17B10RXRA
SCHEMBL22701139 0.74 CYP26A1 (1.00) CYP26A1CYP26B1ALDH1A1HPGDRXRA
SCHEMBL6809650 0.73 CYP26A1 (0.52) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL7684752 0.73 CYP26A1 (0.55) CYP26A1CYP26B1RXRA
SCHEMBL13986018 0.73 CYP26A1 (0.54) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL13613837 0.73 CYP26A1 (0.49) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL22838044 0.72 CYP26A1 (0.51) CYP26A1CYP26B1RXRARXRBRXRG

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-20020193578-A1 Compounds having activity as inhibitors of cytochrome P450RAI ALLERGAN, INC. 2002-12-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020193578-A1 Compounds having activity as inhibitors of cytochrome P450RAI RARA, RARB, RARG CYP26A1 4/4885CYP26B1 5/4885ALDH1A1 46/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.