SCHEMBL9250190

SCHEMBL9250190

CC1(C)CCC(C)(C)c2cc(OC(=O)c3ccc(C(=O)O)cn3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 13/20 0.59
RXRB P28702 10/20 0.59
RXRG P48443 8/20 0.59
CYP26A1 O43174 5/20 0.53
CYP26B1 Q9NR63 4/20 0.53
CYP3A4 P08684 3/20 0.53
RARB P10826 6/20 0.51
RARG P13631 6/20 0.51
RARA P10276 5/20 0.51
PPARG P37231 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
SCHEMBL9175151 0.83 RXRA (0.74) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL727936 0.80 RXRA (0.74) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL9594812 0.79 RXRA (0.56) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL8557337 0.78 RARB (0.73) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL9165893 0.78 RXRA (0.69) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL9175054 0.77 RXRA (0.60) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL9595211 0.75 RARB (0.60) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL6890738 0.75 RXRA (0.78) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL7720657 0.74 RXRA (1.00) RXRARXRBRXRGCYP26A1CYP26B1
SCHEMBL7028435 0.74 RXRA (0.56) RXRARXRBRXRGCYP26A1CYP26B1

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
EP-0642499-A1 RETINOIDS AND THEIR USE IN TREATING SKIN DISEASES AND LEUKEMIA PFIZER INC. (US) 1995-03-15 EP disclosed
WO-1993006086-A1 RETINOIDS AND THEIR USE IN TREATING SKIN DISEASES AND LEUKEMIA PFIZER INC. (US) 1993-04-01 WO disclosed