SCHEMBL495820

SCHEMBL495820

CC(C)(C)c1ccc(C(=O)O)c(N[C@H]2CCCC[C@@H]2N2CCCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
AKR1C3 P42330 2/20 0.40
AKR1C2 P52895 2/20 0.40
TDP1 Q9NUW8 1/20 0.38
GAA P10253 1/20 0.37
CHRNA7 P36544 1/20 0.37
PTGES O14684 1/20 0.36

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
SCHEMBL495525 0.88 ALDH1A1 (0.44) SIGMAR1
SCHEMBL495853 0.88 ALDH1A1 (0.44) SIGMAR1
SCHEMBL496251 0.82 SIGMAR1 (0.48) SIGMAR1PTGES
SCHEMBL495996 0.82 SIGMAR1 (0.48) SIGMAR1PTGES
SCHEMBL497074 0.81 SIGMAR1 (0.47) SIGMAR1CHRNA7PTGES
Fumaric Acid SCHEMBL496597 0.75 TRPV1 (0.41)
Fumaric Acid SCHEMBL496599 0.75 TRPV1 (0.41)
SCHEMBL22853402 0.72 TAS1R3 (0.52)
SCHEMBL22853403 0.72 TAS1R3 (0.52)
SCHEMBL30294318 0.72 TAS1R3 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1955697-B1 2-AMINOBENZAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) INHIBITORS USEFUL FOR THE TREATMENT OF PAIN OR BLADDER FUNCTION DISORDER ASTELLAS PHARMA INC (JP) 2012-05-02 EP disclosed
US-8106190-B2 2-aminobenzamide derivatives ASTELLAS PHARMA INC. (JP) 2012-01-31 US disclosed
US-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-09-17 US disclosed
EP-1955697-A1 2-AMINOBENZAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-08-13 EP 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-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE TRPV1, TRPV2, TRPV5 SIGMAR1 923/4885AKR1C3 827/4885AKR1C2 748/4885

“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.