SCHEMBL9739737

SCHEMBL9739737

COC(N)=Nc1nc(C)cc(OC)n1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 5/20 0.48
CRHR2 Q13324 5/20 0.48
KMT2A Q03164 5/20 0.46
LMNA P02545 4/20 0.46
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
AHR P35869 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 4/20 0.40
CYP1A2 P05177 2/20 0.40
POLB P06746 2/20 0.40
CYP2D6 P10635 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 2/20 0.39
F2 P00734 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 1/20 0.38
NR4A1 P22736 1/20 0.38

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
SCHEMBL9740218 0.90 L3MBTL1 (0.44) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9739709 0.88 CRHBP (0.54) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9621874 0.84 CRHBP (0.52) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9621876 0.84 CRHBP (0.52) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9741157 0.82 ALDH1A1 (0.39) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL10866520 0.80 CRHBP (0.49) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9741191 0.80 CRHBP (0.44) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9740905 0.77 POLB (0.40) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9621901 0.72 CRHBP (0.43) CRHBPCRHR2KMT2ALMNAHTT
SCHEMBL9621906 0.72 CRHBP (0.43) CRHBPCRHR2KMT2ALMNAHTT

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-5126454-A PROCESS FOR THE PREPARATION OF SULPHONYLISOUREAS BAYER AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed