SCHEMBL31695136

SCHEMBL31695136

NC(=O)c1ccc(NC2CCC(C(=O)O)CC2)nc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 3/20 0.66
NNMT P40261 2/20 0.53
CCR6 P51684 1/20 0.47
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
PRKAB2 O43741 1/20 0.44
PRKAG1 P54619 1/20 0.44
PRKAA2 P54646 1/20 0.44
PRKAA1 Q13131 1/20 0.44
PRKAG3 Q9UGI9 1/20 0.44
PRKAG2 Q9UGJ0 1/20 0.44
PRKAB1 Q9Y478 1/20 0.44
DGAT1 O75907 1/20 0.43
KCNH2 Q12809 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
SYK P43405 1/20 0.41
EPHX2 P34913 1/20 0.41

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
SCHEMBL1937458 0.85 HCAR3 (0.65) HCAR3NNMTCCR6KCNQ3KCNQ2
SCHEMBL1937459 0.85 HCAR3 (0.65) HCAR3NNMTCCR6KCNQ3KCNQ2
SCHEMBL17276030 0.84 HCAR3 (0.72) HCAR3NNMTCCR6PRKAB2PRKAG1
SCHEMBL1938176 0.81 HCAR3 (0.59) HCAR3NNMTCCR6
SCHEMBL13463628 0.81 HCAR3 (0.58) HCAR3NNMTCCR6KCNQ3KCNQ2
Hydrochloric Acid SCHEMBL2416614 0.80 HCAR3 (0.57) HCAR3NNMTCCR6
SCHEMBL1542481 0.80 HCAR3 (1.00) HCAR3KCNQ3KCNQ2PRKAB2PRKAG1
SCHEMBL16737383 0.79 HCAR3 (0.56) HCAR3DGAT1KCNH2SMN1; SMN2SYK
SCHEMBL16737384 0.79 HCAR3 (0.56) HCAR3DGAT1KCNH2SMN1; SMN2SYK
SCHEMBL3466282 0.79 NNMT (0.58) NNMTEPHX2

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-20250313574-A1 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME EISAI R&D MANAGEMENT CO., LTD. (JP) 2025-10-09 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-20250313574-A1 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME NEU1, NEU2, NEU4 HCAR3 492/4885NNMT 786/4885CCR6 2345/4885

“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.