SCHEMBL2719810

SCHEMBL2719810

Nc1nccc(Cc2cccs2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ GRM4 Q14833 1/20 0.45
▸ HTR6 P50406 1/20 0.42
▸ HSP90AA1 P07900 2/20 0.40
▸ PIK3CD O00329 1/20 0.40
▸ PIK3CB P42338 1/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.39
▸ PNP P00491 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ADRA1D P25100 2/20 0.38
▸ ADCY10 Q96PN6 2/20 0.38
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ HRH4 Q9H3N8 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ PRKACA P17612 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ FBP1 P09467 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
SCHEMBL11375889 0.77 PIK3CD (0.39) KDM4EALDH1A1HTR6PIK3CDPIK3CB
SCHEMBL27923978 0.73 TAAR1 (0.51) HTR6PIK3CDPIK3CBTAAR1PNP
SCHEMBL29194643 0.72 PIK3CD (0.41) KDM4EHTR6PIK3CDPIK3CBTAAR1
SCHEMBL3957456 0.72 — —
SCHEMBL29167134 0.72 HTR6 (0.64) KDM4EHTR6PIK3CDPIK3CBTAAR1
SCHEMBL1494107 0.72 AURKA (0.48) GRM4HSP90AA1HRH4AURKAPRKACA
SCHEMBL2752018 0.72 SMN1; SMN2 (0.46) KDM4EALDH1A1HTR6TAAR1TSHR
SCHEMBL21241290 0.71 ADRA1D (0.39) KDM4EALDH1A1TAAR1TSHRLMNA
SCHEMBL6920988 0.70 L3MBTL1 (0.51) ALDH1A1GRM4HSP90AA1TAAR1PNP
SCHEMBL9539329 0.70 PIK3CD (0.43) KDM4EALDH1A1HTR6PIK3CDPIK3CB

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
EP-2635572-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2013-09-11 — — EP disclosed
WO-2012061698-A9 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. (US) 2012-09-13 — — WO disclosed
WO-2012061698-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. (US) 2012-05-10 — — WO disclosed
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