SCHEMBL495472

SCHEMBL495472

CN(C)[C@@H]1CCCC[C@H]1Nc1cc(C(F)(F)F)ccc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TAS2R14 Q9NYV8 3/20 0.44
LIPC P11150 1/20 0.44
LIPG Q9Y5X9 1/20 0.44
GRIK1 P39086 1/20 0.43
ACLY P53396 1/20 0.41
KDM1A O60341 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
USP2 O75604 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39

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
SCHEMBL22853402 0.84 TAS1R3 (0.52) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL30294318 0.84 TAS1R3 (0.52) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL22853403 0.84 TAS1R3 (0.52) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL30294454 0.84 TAS1R3 (0.52) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL495853 0.79 ALDH1A1 (0.44) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL495525 0.79 ALDH1A1 (0.44) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL496065 0.79 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10TAS2R14
SCHEMBL496871 0.78 TAS2R14 (0.40) TAS2R14PTK2
SCHEMBL496549 0.76 SCN10A (0.41) PTK2PTK2B
SCHEMBL496254 0.76 CFTR (0.44) MAPTMEN1TSHRKMT2APOLB

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 KDM4E 2205/4885ALDH1A1 1210/4885HPGD 582/4885

“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.