SCHEMBL10583553

SCHEMBL10583553

CCC(c1cc(OC)c(OC)c(OC)c1)(c1cccs1)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ OPRM1 P35372 2/20 0.40
▸ OPRD1 P41143 2/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ BRD4 O60885 1/20 0.37

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
SCHEMBL9799412 0.78 L3MBTL1 (0.37) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9799289 0.77 OPRM1 (0.43) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9799232 0.73 OPRM1 (0.40) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL10560140 0.73 L3MBTL1 (0.51) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9831867 0.73 OPRM1 (0.40) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9832363 0.73 OPRM1 (0.43) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9833083 0.72 OPRM1 (0.40) L3MBTL1OPRM1OPRD1NR1I2CHRM2
Hydrochloric Acid SCHEMBL9799390 0.71 CYP3A4 (0.43) L3MBTL1ALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL9832805 0.71 OPRM1 (0.70) L3MBTL1OPRM1OPRD1NR1I2CHRM2
SCHEMBL9834231 0.70 L3MBTL1 (0.53) L3MBTL1OPRM1OPRD1NR1I2CHRM2

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
EP-0298703-A1 A thiophene derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1989-01-11 — — EP claimed
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