SCHEMBL1936858

SCHEMBL1936858

CCOC(=O)c1c(-c2ccc(F)cc2)nn2cc(NS(C)(=O)=O)c(OCc3ccccc3)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP19A1 P11511 3/20 0.40
TP53 P04637 1/20 0.39
ESRRA P11474 1/20 0.38
PPIA P62937 1/20 0.38
MAPT P10636 1/20 0.38
PTPN1 P18031 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CDK2 P24941 1/20 0.37
CDK9 P50750 1/20 0.37
SSTR5 P35346 1/20 0.37
EGFR P00533 1/20 0.37
SLC34A1 Q06495 2/20 0.37

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
SCHEMBL2997871 0.91 BRAF (0.42) LMNAKDM4EALDH1A1MEN1GAA
SCHEMBL14563822 0.91 CYP19A1 (0.43) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL2997423 0.87 LMNA (0.38) LMNAKDM4EALDH1A1MEN1GAA
SCHEMBL4792937 0.87 KMT2A (0.41) KDM4EALDH1A1MEN1GAAHPGD
SCHEMBL17332244 0.87 BRD4 (0.38) LMNAKDM4EALDH1A1KMT2AMAPT
SCHEMBL2469793 0.85 LMNA (0.40) LMNAKDM4EALDH1A1MEN1GAA
SCHEMBL17332217 0.85 BRD4 (0.39) LMNAALDH1A1PPIAMAPTSSTR5
SCHEMBL2987982 0.83 BRAF (0.44) GAATP53MAPT
SCHEMBL17332238 0.83 BRD4 (0.38) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL2464080 0.82 LMNA (0.37) LMNAKDM4EALDH1A1MEN1GAA

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 11 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
EP-2545050-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C Bristol-Myers Squibb Company (US) 2013-01-16 EP 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
WO-2011112186-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2011-09-15 WO disclosed
EP-2331502-A2 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C Bristol-Myers Squibb Company (US) 2011-06-15 EP disclosed
US-20100184800-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 US disclosed
WO-2010030538-A2 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2010-03-18 WO 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 LMNA 3141/4885KDM4E 4005/4885ALDH1A1 447/4885
US-20100184800-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 LMNA 3141/4885KDM4E 4005/4885ALDH1A1 447/4885
US-20120232099-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 LMNA 3141/4885KDM4E 4005/4885ALDH1A1 447/4885

“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.