SCHEMBL26071067

SCHEMBL26071067

Cc1cc(COc2cccc(-c3nn[nH]c3N)c2)c(-c2ccccc2)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.40
TP53 P04637 2/20 0.39
POLB P06746 1/20 0.39
IGF1R P08069 1/20 0.37
SLC22A12 Q96S37 1/20 0.36
KDR P35968 1/20 0.36
SMN1; SMN2 Q16637 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
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CFD P00746 1/20 0.33
ALOX15 P16050 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
SCHEMBL18006427 0.86 TP53 (0.40) PTGER4TP53POLBSLC22A12KDR
SCHEMBL26071086 0.80 SLC22A12 (0.40) TP53POLBIGF1RSLC22A12SMN1; SMN2
SCHEMBL26071016 0.80 SLC22A12 (0.38) SLC22A12SMN1; SMN2JAK3MAPTALDH1A1
SCHEMBL26071072 0.77 SLC22A12 (0.40) IGF1RSLC22A12PIK3CDPIK3CAPIK3CB
SCHEMBL26071092 0.74 IGF1R (0.39) IGF1RSLC22A12PIK3CDPIK3CAPIK3CB
SCHEMBL26070959 0.74 AKT1 (0.38) IGF1RSLC22A12PIK3CDPIK3CAPIK3CB
SCHEMBL26070963 0.74 EGFR (0.43) PTGER4PIK3CACFDMAPK1KDM4E
SCHEMBL26071083 0.73 SLC22A12 (0.38) POLBIGF1RSLC22A12SMN1; SMN2PIK3CD
SCHEMBL26071079 0.73 IGF1R (0.35) IGF1RSLC22A12SMN1; SMN2PIK3CDPIK3CA
SCHEMBL26070898 0.73 BTK (0.49) TP53SLC22A12SMN1; SMN2PIK3CGMAPT

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