SCHEMBL91572

SCHEMBL91572

CCc1csc(NC(=O)Oc2ccccc2)n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.66
NPC1 O15118 4/20 0.66
MAPT P10636 2/20 0.66
PKM P14618 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
ALDH1A1 P00352 5/20 0.56
POLB P06746 1/20 0.53
MIF P14174 1/20 0.53
GAA P10253 2/20 0.53
PDE5A O76074 1/20 0.51
LMNA P02545 5/20 0.50
HTT P42858 4/20 0.50
MAPK1 P28482 2/20 0.50
KDM4E B2RXH2 2/20 0.50
TP53 P04637 1/20 0.50
CCNE1 P24864 1/20 0.49
CDK2 P24941 1/20 0.49
CDK5 Q00535 1/20 0.49

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
SCHEMBL10081944 0.88 MAPT (0.52) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL10081817 0.88 TP53 (0.54) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL91554 0.86 PDE5A (0.53) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL3513842 0.83 NPC1 (0.54) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL10084516 0.83 SMN1; SMN2 (0.62) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL4780444 0.81 NPC1 (0.57) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL146652 0.81 NPC1 (0.64) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL10084297 0.81 TSHR (0.52) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL91391 0.80 KDM4E (0.69) RAB9ANPC1MAPTPKMSMN1; SMN2
SCHEMBL7139983 0.79 SMN1; SMN2 (0.72) RAB9ANPC1MAPTPKMSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 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-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 RAB9A 3465/4885NPC1 3856/4885MAPT 2769/4885

“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.