SCHEMBL26613645

SCHEMBL26613645

Cc1ccc(Cc2ncc[nH]2)c(-c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 0.54
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
HTR1A P08908 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ADORA3 P0DMS8 2/20 0.40
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
ADORA2B P29275 1/20 0.40
PSMB5 P28074 1/20 0.39
NISCH Q9Y2I1 2/20 0.39
MTOR P42345 1/20 0.39
ADK P55263 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
CYP2D6 P10635 1/20 0.37
TSHR P16473 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
SCHEMBL11464502 0.82 TAAR1 (0.59) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL11291001 0.79 TAAR1 (0.54) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL954941 0.76 TAAR1 (0.54) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL11354909 0.76 TAAR1 (0.55) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL10944914 0.74 AMY1A (0.51) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL705967 0.74 TAAR1 (0.47) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL28103549 0.73 ADRA2A (0.69) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL5935186 0.72 TAAR1 (0.79) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL1509682 0.72 TAAR1 (0.67) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL9243 0.71 TAAR1 (1.00) TAAR1ADRA2AADRA2BADRA2CHTR1A

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
WO-2023210058-A1 INSULATED ELECTRIC WIRE, COIL USING SAME, AND METHOD FOR MANUFACTURING INSULATED ELECTRIC WIRE 株式会社TOTOKU 2023-11-02 WO disclosed