SCHEMBL29601491

SCHEMBL29601491

CCC(=O)Nc1sc2c(c1C(=O)O)CCOC2

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.70
PTPN2 P17706 1/20 0.70
PTPN1 P18031 1/20 0.70
PTPRB P23467 1/20 0.70
PTPRE P23469 1/20 0.70
ANO1 Q5XXA6 2/20 0.64
RAB7A P51149 1/20 0.56
CNR2 P34972 8/20 0.53
FLT3 P36888 1/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.52
KIF11 P52732 1/20 0.51
CFTR P13569 1/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
ABCC1 P33527 2/20 0.47
CNR1 P21554 1/20 0.46

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
SCHEMBL5453432 0.83 PTPN1 (0.71) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4312414 0.82 PTPN1 (1.00) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL5741314 0.82 PTPN1 (0.75) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL20541702 0.81 KDM4E (0.77) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4090461 0.81 CNR2 (0.70) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL20541804 0.80 FLT3 (0.75) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL4141589 0.79 PTPRC (0.70) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL20541770 0.79 ANO1 (1.00) ANO1CNR2KIF11CFTRCNR1
SCHEMBL3760411 0.77 PTPN1 (0.67) PTPRCPTPN2PTPN1PTPRBPTPRE
SCHEMBL5451710 0.77 CFTR (0.58) PTPRCPTPN2PTPN1PTPRBPTPRE

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-11358947-B2 Substituted 2-acylamino-cycloalkylthiophene-3-carboxylic acid arylamides as inhibitors of calcium-activated chloride channel TMEM16A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-06-14 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-11358947-B2 Substituted 2-acylamino-cycloalkylthiophene-3-carboxylic acid arylamides as inhibitors of calcium-activated chloride channel TMEM16A TMEM161A, ANO2, TRPV6 PTPRC 1726/4885PTPN2 3627/4885PTPN1 4191/4885

“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.