SCHEMBL10409237

SCHEMBL10409237

CCOC(=O)c1ccccc1C(=O)Oc1ccc2c(c1)C(C)(C)CC(C)(C)S2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
RARA P10276 4/20 0.44
RARB P10826 4/20 0.44
RARG P13631 1/20 0.44
CDC25B P30305 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39
DDX3X O00571 1/20 0.37
TP53 P04637 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 2/20 0.37
MAPT P10636 1/20 0.37
CYP1A2 P05177 1/20 0.37
GAA P10253 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL10409337 0.88 RARA (0.47) RARARARBRARGCDC25BALDH1A1
SCHEMBL10409282 0.87 RARA (0.54) RARARARBRARGTP53MEN1
SCHEMBL10409342 0.86 RARA (0.46) TSHRRARARARBRARGHSD17B10
SCHEMBL10409278 0.83 RARA (0.49) TSHRRARARARBRARGCDC25B
SCHEMBL9187392 0.82 RARA (0.47) TSHRRARARARBRARGALDH1A1
SCHEMBL9189688 0.81 RARA (0.45) TSHRRARARARBRARGCDC25B
SCHEMBL8461598 0.81 RARA (0.57) RARARARBRARGKMT2AMAPT
SCHEMBL9190027 0.81 RARA (0.47) RARARARBRARGALDH1A1MEN1
SCHEMBL9191642 0.80 RARA (0.58) RARARARBRARGHSD17B10TP53
SCHEMBL9188912 0.78 RARA (0.42) TSHRRARARARBRARGALDH1A1

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-4895868-A PSORIASIS, SKIN DISORDERS, ANTIARTHRITIC, WOUND HEALING, EYE DRYNESS ALLERGAN, INC. (US) 1990-01-23 US disclosed