SCHEMBL2769713

SCHEMBL2769713

CCN(C(=O)O)[C@@H](C)COC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.32
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30

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
SCHEMBL19356111 0.83 CHRNB2 (0.33) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL19356112 0.82 THRB (0.31) THRB
SCHEMBL967292 0.78 PGR (0.31)
SCHEMBL15011877 0.74 KMT2A (0.54) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20186794 0.74 GABRR1 (0.33)
SCHEMBL20186756 0.74 GABRR1 (0.33)
SCHEMBL15016144 0.74
SCHEMBL16741679 0.74 CHRNB2 (0.35) THRBCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20186754 0.74 GABRR1 (0.33)
SCHEMBL19814582 0.74 CHRNB2 (0.35) THRBCHRNB2CHRNB4CHRNA3CHRNA4

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
US-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2010-09-30 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-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF TRPV1, FGFR3, GPR17 THRB 1145/4885CHRNB2 871/4885CHRNB4 1181/4885

“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.