SCHEMBL14726219

SCHEMBL14726219

CC(NC(=O)Nc1ccc(NS(N)(=O)=O)cc1)c1cccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 1/20 0.61
▸ TRPV1 Q8NER1 2/20 0.50
▸ EPHX2 P34913 2/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ GAA P10253 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
SCHEMBL31616384 0.83 IDH1 (0.54) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL31616459 0.83 IDH1 (0.69) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL31616412 0.83 IDH1 (0.54) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL31616462 0.83 IDH1 (0.69) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL31616425 0.83 IDH1 (0.54) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL31616396 0.83 IDH1 (0.69) IDH1TRPV1EPHX2LMNAGAA
SCHEMBL19377027 0.81 IDH1 (0.58) IDH1TRPV1EPHX2LMNA
SCHEMBL31616465 0.81 KMT2A (0.53) IDH1TRPV1LMNA
SCHEMBL31616452 0.81 KMT2A (0.53) IDH1TRPV1LMNA
SCHEMBL31616458 0.81 KMT2A (0.53) IDH1TRPV1LMNA

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-20130053392-A1 CARBONIC ANHYDRASE INHIBITORS UNIVERSITETET I OSLO (NO) 2013-02-28 — — 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-20130053392-A1 CARBONIC ANHYDRASE INHIBITORS CA9, CA2, CA4 IDH1 70/4885TRPV1 860/4885EPHX2 203/4885

“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.

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