SCHEMBL9713764

SCHEMBL9713764

CC(=O)Oc1c(Sc2ccccc2)c(-c2ccccc2)c2ccc(Cl)cc2c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.46
ALDH1A1 P00352 4/20 0.44
MAP2 P11137 2/20 0.42
MAPT P10636 3/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
PPARG P37231 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
BACE1 P56817 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39

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
SCHEMBL9713656 0.79 ABCB11 (0.48) ABCB11ALDH1A1MAP2MAPTHPGD
SCHEMBL10502752 0.79 PDE4A (0.40) ABCB11ALDH1A1MAPTHPGDMEN1
SCHEMBL10503628 0.79 ABCB11 (0.64) ABCB11ALDH1A1MAP2MAPTHPGD
SCHEMBL9713703 0.76 ABCB11 (0.51) ABCB11ALDH1A1MAPTHPGDMEN1
SCHEMBL27971141 0.71 MAP2 (0.62) ALDH1A1MAP2MAPTHPGDMEN1
SCHEMBL10503117 0.71 KDM4E (0.49) ALDH1A1MAPTHPGDMEN1TSHR
SCHEMBL29371228 0.71 ABCB11 (0.73) ABCB11ALDH1A1MAP2MAPTHPGD
SCHEMBL10503448 0.69 MAPT (0.43) ABCB11MAPTMEN1CYP3A4ALOX15
SCHEMBL10742406 0.69 ABCB11 (0.48) ABCB11MAP2MAPTHSD17B10BACE1
SCHEMBL9643184 0.68 MRGPRX4 (0.42) ABCB11ALDH1A1MAP2MAPTHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed