SCHEMBL2984692

SCHEMBL2984692

CCCS(=O)(=O)Nc1cn2nc(-c3ccc(F)cc3)c(C(=O)O)c2cc1-c1cccc(C(=O)NC(C)(C)c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.41
PPARG P37231 2/20 0.36
KAT6A Q92794 1/20 0.35
PHGDH O43175 1/20 0.34
DGAT2 Q96PD7 1/20 0.34
CSNK1E P49674 1/20 0.34

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
SCHEMBL2999644 0.94 BRAF (0.40) BRAFPPARGDGAT2CSNK1E
SCHEMBL2994355 0.93 BRAF (0.36) BRAFPPARGKAT6APHGDHDGAT2
SCHEMBL2996833 0.92 BRAF (0.35) BRAFPPARGKAT6APHGDHDGAT2
SCHEMBL2466121 0.90 KAT6A (0.37) PPARGKAT6APHGDHDGAT2CSNK1E
SCHEMBL2991607 0.88 PPARG (0.35) BRAFPPARGDGAT2CSNK1E
SCHEMBL2989353 0.87 BRAF (0.46) BRAF
SCHEMBL2994049 0.87 BRAF (0.35) BRAFPPARGDGAT2CSNK1E
SCHEMBL2993656 0.86 ACLY (0.35) BRAFPPARGDGAT2CSNK1E
SCHEMBL1936819 0.86 PPARG (0.35) BRAFPPARGPHGDHDGAT2CSNK1E
SCHEMBL1936614 0.85 PPARG (0.37) PPARGKAT6APHGDHDGAT2CSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2331502-B1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2016-03-02 EP disclosed
US-8536338-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2013-09-17 US disclosed
US-8293909-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-10-23 US disclosed
US-20120232099-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2012-09-13 US disclosed
US-8198449-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-06-12 US disclosed
US-20100184800-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 US disclosed
US-20100063068-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 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 (3 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-20100063068-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 BRAF 3154/4885PPARG 716/4885KAT6A 2390/4885
US-20100184800-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 BRAF 3154/4885PPARG 716/4885KAT6A 2390/4885
US-20120232099-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 BRAF 3154/4885PPARG 716/4885KAT6A 2390/4885

“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.