SCHEMBL3659152

SCHEMBL3659152

c1ccc(-c2c(-n3cncn3)ncnc2-n2cncn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
PIM1 P11309 1/20 0.43
MAPK10 P53779 1/20 0.41
CYP2A6 P11509 1/20 0.40
CYP19A1 P11511 5/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 1/20 0.37
CYP17A1 P05093 1/20 0.36
ALDH1A1 P00352 4/20 0.36
POLB P06746 1/20 0.36
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
IMPDH2 P12268 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
SCHEMBL3625169 0.77 CYP17A1 (0.52) LMNACYP2A6CYP19A1MEN1KMT2A
SCHEMBL13140082 0.75 EDNRB (0.34) LMNAPIM1MAPK10CYP19A1KDM4E
SCHEMBL3627670 0.75 SLC9A1 (0.33) LMNAPIM1CYP19A1KDM4EMAPT
SCHEMBL2788049 0.75 CYP2A6 (0.44) LMNAPIM1MAPK10CYP2A6CYP19A1
SCHEMBL17994856 0.74 PTK2 (0.47) LMNAPIM1CYP2A6SMN1; SMN2HTT
SCHEMBL11249373 0.72 ALDH1A1 (0.56) LMNAPIM1MAPK10CYP2A6CYP19A1
SCHEMBL3624702 0.71 ADORA2A (0.44) LMNACYP2A6KDM4EMAPTSMN1; SMN2
SCHEMBL3620056 0.71 CYP17A1 (0.37) LMNACYP2A6CYP19A1KDM4EMAPT
SCHEMBL3628999 0.71 KDM4E (0.37) LMNACYP2A6KDM4ESMN1; SMN2CYP17A1
SCHEMBL3626938 0.71 KDM4E (0.37) LMNACYP2A6KDM4EMAPTSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010119878-A1 PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-21 WO disclosed
WO-2010119878-A1 PYRIMIDINE COMPOUND AND ITS USE FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-21 WO disclosed