SCHEMBL2997423

SCHEMBL2997423

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

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
TP53 P04637 1/20 0.34
NPSR1 Q6W5P4 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
PPIA P62937 1/20 0.34
MAPT P10636 1/20 0.34
F2RL3 Q96RI0 1/20 0.34
SLC34A1 Q06495 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CSNK1D P48730 1/20 0.33
EGFR P00533 1/20 0.33
RORC P51449 2/20 0.33

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 0.88 BRAF (0.42) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL1936858 0.87 LMNA (0.42) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL17332244 0.84 BRD4 (0.38) LMNAKMT2AALDH1A1KDM4EMAPT
SCHEMBL17332217 0.83 BRD4 (0.39) LMNAALDH1A1PPIAMAPTL3MBTL1
SCHEMBL2464080 0.82 LMNA (0.37) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL17530712 0.81 ALDH1A1 (0.36) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL2987982 0.81 BRAF (0.44) GAATP53SMN1; SMN2MAPT
SCHEMBL17332238 0.81 BRD4 (0.38) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL2994042 0.79 BRAF (0.44)
SCHEMBL14563822 0.79 CYP19A1 (0.43) LMNAMEN1KMT2AALDH1A1KDM4E

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 LMNA 3141/4885MEN1 4795/4885KMT2A 4722/4885
US-20100184800-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 LMNA 3141/4885MEN1 4795/4885KMT2A 4722/4885
US-20120232099-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 LMNA 3141/4885MEN1 4795/4885KMT2A 4722/4885

“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.