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Sugi Predict / Compounds / SCHEMBL9702383

SCHEMBL9702383

SCHEMBL9702383

CC(Cc1ccccc1)c1ccc2c(c1)C(C)(C)CCC2(C)C.CC1(C)CCC(C)(C)c2cc(-c3ccc4cc(C(=O)O)ccc4c3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 15/20 0.69
▸ RARG P13631 14/20 0.69
▸ RARA P10276 14/20 0.69
▸ CYP26A1 O43174 4/20 0.55
▸ CYP26B1 Q9NR63 4/20 0.55
▸ RXRA P19793 3/20 0.54
▸ RXRB P28702 1/20 0.54
▸ CYP3A4 P08684 1/20 0.50

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
SCHEMBL7154631 0.85 RXRA (0.70) RARBRARGRARACYP26A1CYP26B1
SCHEMBL2331952 0.83 RARB (1.00) RARBRARGRARACYP26A1CYP26B1
SCHEMBL8736104 0.81 RXRA (0.50) RARBRARGRARACYP26A1CYP26B1
SCHEMBL9374463 0.79 RARA (0.90) RARBRARGRARACYP26A1CYP26B1
SCHEMBL10541551 0.78 RARB (0.79) RARBRARGRARACYP26A1CYP26B1
SCHEMBL6372648 0.77 RARB (1.00) RARBRARGRARACYP26A1CYP26B1
SCHEMBL5712092 0.76 RARB (0.79) RARBRARGRARACYP26A1CYP26B1
Temarotene SCHEMBL8435859 0.75 RARB (0.72) RARBRARGRARACYP26A1CYP26B1
SCHEMBL8950182 0.74 RARB (0.79) RARBRARGRARACYP26A1CYP26B1
SCHEMBL6148372 0.74 CYP26A1 (0.58) RARBRARGRARACYP26A1CYP26B1

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
WO-1992015290-A1 METHODS FOR TREATMENT OF SCARRING FIBROTIC ALOPECIA KLIGMAN ALBERT M (US) 1992-09-17 — — WO disclosed