SCHEMBL1764786

SCHEMBL1764786

CC(=O)Nc1cccc(-c2csc(C)n2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.70
LMNA P02545 3/20 0.68
NPC1 O15118 9/20 0.65
RAB9A P51151 9/20 0.65
SMN1; SMN2 Q16637 9/20 0.65
NFKB1 P19838 5/20 0.65
NFKB2 Q00653 5/20 0.65
RELA Q04206 5/20 0.65
ALDH1A1 P00352 5/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
HTT P42858 4/20 0.64
MEN1 O00255 6/20 0.61
KMT2A Q03164 6/20 0.61
KDM4E B2RXH2 5/20 0.61
TP53 P04637 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
CASP3 P42574 1/20 0.61
GFER P55789 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61

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
SCHEMBL8057745 0.88 MAPT (0.68) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL28527743 0.86 MAPT (0.76) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL3140270 0.86 SMN1; SMN2 (0.65) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL19267603 0.82 RAB9A (0.72) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL14640404 0.82 MAPT (0.61) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL4455272 0.81 LMNA (0.65) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL14325740 0.80 MAPT (0.53) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL3612694 0.80 MAPT (0.67) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL10061659 0.80 MAPT (0.64) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL2229720 0.79 MAPT (0.63) MAPTLMNANPC1RAB9ASMN1; 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-8288435-B2 2-aza-bicyclo[3.1.0]hexane derivatives as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2012-10-16 US disclosed
US-20110124636-A1 2-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-05-26 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-20110124636-A1 2-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, CNR1 MAPT 3585/4885LMNA 3001/4885NPC1 937/4885

“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.