SCHEMBL26071072

SCHEMBL26071072

Cc1ccc(Cl)cc1COc1cccc(-c2nn[nH]c2N)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.40
NR1H2 P55055 3/20 0.39
BACE1 P56817 1/20 0.37
INPPL1 O15357 2/20 0.37
DHFR P00374 1/20 0.37
DCPS Q96C86 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
HTR6 P50406 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35
PRKDC P78527 1/20 0.35
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 1/20 0.34
ROCK2 O75116 1/20 0.34
GRK2 P25098 1/20 0.34

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
SCHEMBL18006430 0.85 SLC22A12 (0.39) SLC22A12NR1H2INPPL1KMT2AMEN1
SCHEMBL26071070 0.80 SMN1; SMN2 (0.45) DHFRKMT2AMEN1ROCK2GRK2
SCHEMBL26070911 0.79 CYP2C9 (0.47) KMT2AMEN1TSHR
SCHEMBL26071067 0.77 PTGER4 (0.40) SLC22A12KMT2AMEN1TSHRPIK3CD
SCHEMBL26071018 0.76 NOTUM (0.38) SLC22A12IGF1R
SCHEMBL26071092 0.76 IGF1R (0.39) SLC22A12KMT2AMEN1PIK3CDPIK3CA
SCHEMBL26070951 0.76 SIRT2 (0.42) BACE1DHFRHTR6IGF1R
SCHEMBL26071083 0.75 SLC22A12 (0.38) SLC22A12KMT2AMEN1TSHRPIK3CD
SCHEMBL26071016 0.75 SLC22A12 (0.38) SLC22A12TSHRROCK2ALOX5AP
SCHEMBL26070898 0.74 BTK (0.49) SLC22A12TSHRPIK3CGFGFR2FGFR3

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-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed