SCHEMBL10537367

SCHEMBL10537367

N#CC1(Nc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.59
GAA P10253 2/20 0.50
PDE4A P27815 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA13 Q8N1Q1 1/20 0.47
CA14 Q9ULX7 1/20 0.47
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
CTSL P07711 5/20 0.41
CTSS P25774 4/20 0.39
CTSK P43235 4/20 0.39
CTSB P07858 3/20 0.39
POLB P06746 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
SCHEMBL12456081 0.92 CYP1A2 (0.67) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL2538688 0.92 CYP1A2 (0.72) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL2534556 0.90 CYP1A2 (0.70) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL7887937 0.87 SMN1; SMN2 (0.52) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL8520095 0.84 SMN1; SMN2 (0.65) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL27917592 0.82 SMN1; SMN2 (0.48) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL1715467 0.81 CYP1A2 (0.80) CYP1A2SMN1; SMN2GAAPDE4ACA12
SCHEMBL2985757 0.79 SMN1; SMN2 (0.75) CYP1A2SMN1; SMN2CA12CA1CA2
SCHEMBL21874406 0.78 SMN1; SMN2 (0.73) CYP1A2SMN1; SMN2CA12CA1CA2
SCHEMBL13534110 0.78 SMN1; SMN2 (0.73) CYP1A2SMN1; SMN2GAAPDE4ACA12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023244817-A1 SUBSTITUTED PIPERIDINES AS CK1A DEGRADERS MONTE ROSA THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed
US-4824477-A Trifluoromethanesulfonanilide compounds and herbicidal compositions containing them KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-04-25 US disclosed
EP-0265540-A1 Trifluoromethanesulfonanilide compounds and herbicidal compositions containing them KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-05-04 EP disclosed
US-4659371-A NONPHYTOTOXIC TO COTTON KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-04-21 US disclosed