SCHEMBL7750762

SCHEMBL7750762

Cn1nnn(-c2ccccc2Cl)c1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.43
MAPK14 Q16539 6/20 0.41
MAPK11 Q15759 4/20 0.41
OPRM1 P35372 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.38
KCNN4 O15554 1/20 0.38
PDE4B Q07343 1/20 0.38
CDK4 P11802 1/20 0.37
CCND1 P24385 1/20 0.37

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
SCHEMBL7750768 1.00 MGLL (0.43) MGLLMAPK14MAPK11OPRM1ALDH1A1
SCHEMBL18504500 0.85 DRD2 (0.33) MGLLMAPK14MAPK11ALDH1A1SMN1; SMN2
SCHEMBL15351674 0.85 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2PKM
SCHEMBL22349806 0.81 PDE4B (0.45) MGLLMAPK14MAPK11OPRM1ALDH1A1
SCHEMBL17375373 0.81 MAPT (0.34) ALDH1A1SMN1; SMN2MAPT
SCHEMBL15351276 0.81 MAPT (0.34) ALDH1A1MAPT
SCHEMBL16206087 0.80 NOTUM (0.40) SMN1; SMN2MAPT
SCHEMBL28644730 0.79 MGLL (0.46) MGLLMAPK14OPRM1ALDH1A1MAPT
SCHEMBL16690399 0.79 KCNMA1 (0.45) ALDH1A1KDM4EMAPTKCNN4
SCHEMBL9052646 0.79 GSK3A (0.46) MGLLOPRM1

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
WO-2001039595-A2 METHOD FOR INCREASING THE YIELD OF CROPS NIHON BAYER AGROCHEM K.K. (DE) 2001-06-07 WO disclosed