SCHEMBL10690502

SCHEMBL10690502

CSc1cccc(-n2ccnn2)n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 0.45
NOTUM Q6P988 11/20 0.41
KEAP1 Q14145 1/20 0.39
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP19A1 P11511 1/20 0.33
KMT2A Q03164 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
SCHEMBL10685670 0.74 MAP3K5 (0.51) MAP3K5NOTUMKEAP1MAPTNPC1
SCHEMBL15091190 0.74 MAP3K5 (0.51) MAP3K5NOTUMKEAP1MAPTNPC1
SCHEMBL24405876 0.74 MAP3K5 (0.48) MAP3K5NOTUMKEAP1MAPTNPC1
SCHEMBL3510845 0.74 NOTUM (0.50) MAP3K5NOTUMKEAP1KMT2A
SCHEMBL10691319 0.74 MAP3K5 (0.48) MAP3K5NOTUMKEAP1MAPTNPC1
SCHEMBL10685640 0.73 NOTUM (0.51) MAP3K5NOTUMKEAP1MAPTNPC1
SCHEMBL28969422 0.70 MEN1 (0.48) MAP3K5NOTUMKEAP1RAB9ACYP19A1
SCHEMBL10694005 0.70 NOTUM (0.50) MAP3K5NOTUMKEAP1
SCHEMBL8779829 0.69 CCR1 (0.39) KEAP1MAPTNPC1RAB9AL3MBTL1
SCHEMBL15093948 0.68 MAP3K5 (0.49) MAP3K5NOTUMKEAP1

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
US-4775762-A INSECTICIDES THE DOW CHEMICAL COMPANY (US) 1988-10-04 US claimed