SCHEMBL9621874

SCHEMBL9621874

CON/C(N)=N/c1nc(C)cc(OC)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 5/20 0.52
CRHR2 Q13324 5/20 0.52
LMNA P02545 3/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HTT P42858 2/20 0.50
AHR P35869 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 2/20 0.48
CYP1A2 P05177 2/20 0.44
POLB P06746 2/20 0.44
CYP2D6 P10635 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 1/20 0.43
NR4A1 P22736 1/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
RAD52 P43351 1/20 0.41

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
SCHEMBL9621876 1.00 CRHBP (0.52) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9621906 0.90 CRHBP (0.43) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9621901 0.90 CRHBP (0.43) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9621983 0.89 CRHBP (0.59) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9621981 0.89 CRHBP (0.59) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL10866520 0.87 CRHBP (0.49) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9739737 0.84 CRHBP (0.48) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL10926838 0.79 CRHBP (0.47) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9622515 0.75 SMN1; SMN2 (0.42) CRHBPCRHR2LMNAKMT2ASMN1; SMN2
SCHEMBL9622519 0.75 SMN1; SMN2 (0.42) CRHBPCRHR2LMNAKMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0470430-A1 Process for the preparation of oxyguanidins BAYER AG (DE) 1992-02-12 EP disclosed