SCHEMBL10084516

SCHEMBL10084516

CCc1csc(NC(=O)OCc2ccccc2)n1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
MAPK1 P28482 2/20 0.58
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
MAPT P10636 1/20 0.50
PKM P14618 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
HSD17B10 Q99714 1/20 0.49
POLB P06746 1/20 0.49
GCK P35557 1/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HTT P42858 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL4873516 0.88 MAPK1 (0.56) SMN1; SMN2MAPK1NPC1RAB9ALMNA
SCHEMBL10084297 0.88 TSHR (0.52) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL9153870 0.87 MAPK1 (0.55) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL4832627 0.87 ALDH1A1 (0.59) SMN1; SMN2MAPK1NPC1RAB9ALMNA
SCHEMBL27730232 0.87 MAPK1 (0.55) SMN1; SMN2MAPK1NPC1RAB9ALMNA
SCHEMBL27751166 0.87 LMNA (0.69) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL10349418 0.86 TP53 (0.56) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL15331063 0.85 MAPK1 (0.53) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL5835447 0.83 MAPK1 (0.48) SMN1; SMN2MAPK1NPC1RAB9AMAPT
SCHEMBL91510 0.83 MEN1 (0.53) SMN1; SMN2MAPK1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119645-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-11-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 SMN1; SMN2 4328/4885MAPK1 2690/4885NPC1 3836/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.