SCHEMBL10374209

SCHEMBL10374209

CCCCCCCCCOc1oc(C(=O)Nc2nnn[nH]2)c2c(OC)cccc12

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 6/20 0.36
▸ CYSLTR1 Q9Y271 6/20 0.36
▸ UTS2R Q9UKP6 1/20 0.36
▸ SMPD1 P17405 4/20 0.35
▸ PTPN1 P18031 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PLK1 P53350 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
SCHEMBL10373886 0.87 EDNRA (0.35) KDM4EHSD17B10
SCHEMBL10371933 0.84 CYSLTR2 (0.38) CYSLTR2CYSLTR1SMPD1PTPN1
SCHEMBL10372898 0.82 MAPT (0.35) HSD17B10
SCHEMBL10371640 0.78 PPARA (0.46) —
SCHEMBL8225601 0.76 NPC1 (0.43) KDM4EHSD17B10
SCHEMBL10375537 0.75 ALDH1A1 (0.36) KDM4EHSD17B10
SCHEMBL10373930 0.74 MAPT (0.36) KDM4EHSD17B10
SCHEMBL10372259 0.73 MAPT (0.39) KDM4EHSD17B10
SCHEMBL10933029 0.69 BRD4 (0.46) KDM4E
SCHEMBL10372540 0.69 MAPT (0.35) CYSLTR1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187487-B1 BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGIC ACTIVITY WARNER-LAMBERT COMPANY (US) 1990-08-29 — — EP claimed
US-4703053-A Benzothiophenes and benzofurans and antiallergic use thereof WARNER-LAMBERT COMPANY (US) 1987-10-27 — — US claimed
EP-0187487-B1 BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGIC ACTIVITY WARNER-LAMBERT COMPANY (US) 1990-08-29 — — EP disclosed
US-4703053-A Benzothiophenes and benzofurans and antiallergic use thereof WARNER-LAMBERT COMPANY (US) 1987-10-27 — — US disclosed
EP-0187487-A1 Benzothiophenes and benzofurans having antiallergic activity WARNER-LAMBERT COMPANY (US) 1986-07-16 — — EP disclosed
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