SCHEMBL26070928

SCHEMBL26070928

Nc1[nH]nnc1-c1cccc(OCCc2ccsc2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 1/20 0.36
LNPEP Q9UIQ6 1/20 0.35
GP6 Q9HCN6 1/20 0.34
TTK P33981 1/20 0.34
NOTUM Q6P988 1/20 0.34
F9 P00740 1/20 0.34
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
ROCK2 O75116 1/20 0.32
GRK2 P25098 1/20 0.32
BACE1 P56817 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL18006339 0.85 HPGD (0.35) KDM4ESMN1; SMN2HPGDLNPEPGP6
SCHEMBL26070995 0.83 KDM4E (0.42) KDM4ESMN1; SMN2GP6F9TAAR1
SCHEMBL26070926 0.81 TTK (0.52) KDM4ESMN1; SMN2HPGDTTKNOTUM
SCHEMBL26070951 0.81 SIRT2 (0.42) KDM4ESMN1; SMN2GP6TAAR1BACE1
SCHEMBL26070999 0.76 SIRT2 (0.43) KDM4ESMN1; SMN2GP6F9TAAR1
SCHEMBL26071070 0.76 SMN1; SMN2 (0.45) KDM4ESMN1; SMN2TAAR1ROCK2GRK2
SCHEMBL26071075 0.75 CYSLTR2 (0.36) KDM4ESMN1; SMN2HPGDNOTUM
SCHEMBL26070997 0.74 KDM4E (0.40) KDM4ESMN1; SMN2NOTUMFGFR2FGFR3
SCHEMBL26071027 0.74 SIRT2 (0.39) KDM4ESMN1; SMN2HPGDBACE1ADORA2A
SCHEMBL18006341 0.73 PARP15 (0.40) PARP15PARP10PARP3

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