SCHEMBL26070965

SCHEMBL26070965

Nc1[nH]nnc1-c1cccc(OCc2cccc(-n3cccn3)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 9/20 0.42
LMNA P02545 1/20 0.40
MPO P05164 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37
TBK1 Q9UHD2 2/20 0.37
KDM5B Q9UGL1 1/20 0.37
ERCC1 P07992 1/20 0.37
ERCC4 Q92889 1/20 0.37
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
PRKDC P78527 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
IKBKE Q14164 1/20 0.36
TNK2 Q07912 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
SCHEMBL18006362 0.86 LMNA (0.37) IGF1RLMNAMPOSIRT2SIRT1
SCHEMBL26070912 0.78 IGF1R (0.45) IGF1RPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL26070909 0.76 IGF1R (0.42) IGF1RLMNASIRT2SIRT1SIRT3
SCHEMBL26071035 0.76 CYP4F2 (0.46)
SCHEMBL26070984 0.76 IGF1R (0.42) IGF1RPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL26071088 0.74 ADORA2A (0.42) IGF1RMPOPIK3CDPIK3CAPIK3CB
SCHEMBL26070961 0.74 MEN1 (0.42) IGF1R
SCHEMBL26070980 0.73 NOS1 (0.48)
SCHEMBL26071092 0.72 IGF1R (0.39) IGF1RPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL26071059 0.72 PFKFB3 (0.39) IGF1RMPOPIK3CDPIK3CAPIK3CB

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