SCHEMBL21035183

SCHEMBL21035183

O=C1Cc2ccccc2[C@@H](c2ccccc2)N1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.76
KMT2A Q03164 4/20 0.49
GAA P10253 2/20 0.49
PRCP P42785 1/20 0.49
ANPEP P15144 2/20 0.43
AHR P35869 1/20 0.41
PDK2 Q15119 1/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTR2A P28223 2/20 0.40
HTR2C P28335 1/20 0.40
HRH1 P35367 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
TDP2 O95551 1/20 0.39
CASP3 P42574 1/20 0.39
CASP7 P55210 1/20 0.39
CASP9 P55211 1/20 0.39
CASP6 P55212 1/20 0.39

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
SCHEMBL31350550 1.00 SMN1; SMN2 (0.76) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL21035184 1.00 SMN1; SMN2 (0.76) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL11439131 1.00 SMN1; SMN2 (0.76) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL4996430 0.86 SMN1; SMN2 (0.72) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL10850802 0.86 SMN1; SMN2 (0.72) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL7427398 0.86 SMN1; SMN2 (0.72) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL10851883 0.86 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL9627333 0.84 PRCP (0.56) SMN1; SMN2KMT2AGAAPRCPLMNA
SCHEMBL10854587 0.82 SMN1; SMN2 (0.58) SMN1; SMN2KMT2AGAAPRCPANPEP
SCHEMBL10622394 0.82 SMN1; SMN2 (0.58) SMN1; SMN2KMT2AGAAMAPT

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-3489215-A1 PROCESS FOR PRODUCING ORGANIC COMPOUND Kaneka Corporation (JP) 2019-05-29 EP disclosed