SCHEMBL1127477

SCHEMBL1127477

C=CCN(C(=O)O)c1ccc(F)c(-c2nc(N3CCOCC3)sc2-c2ccnc(Cl)n2)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.37
EGFR P00533 4/20 0.36
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RIPK2 O43353 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
ALOX5 P09917 2/20 0.33
PTGS2 P35354 1/20 0.33
ALDH1A1 P00352 4/20 0.33
AR P10275 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL1127552 0.88 KCNH2 (0.37) KCNH2EGFRMEN1KMT2AALOX15
SCHEMBL1127124 0.83 MEN1 (0.36) KCNH2EGFRMEN1KMT2AALOX15
SCHEMBL1127358 0.81 BRAF (0.40) RIPK2
SCHEMBL12350237 0.81 KMT2A (0.38) KCNH2EGFRMEN1KMT2ARIPK2
SCHEMBL1127292 0.81 KMT2A (0.36) KCNH2EGFRMEN1KMT2AALOX15
SCHEMBL3887751 0.80 KCNH2 (0.42) KCNH2EGFRMEN1KMT2ARIPK2
SCHEMBL1127746 0.79 KCNH2 (0.44) KCNH2EGFRALOX15RIPK2MAPT
SCHEMBL1871665 0.73 RIPK2 (0.38) KCNH2EGFRALOX15HSD17B10RIPK2
SCHEMBL1888596 0.73 BRAF (0.45) KCNH2EGFRRIPK2
SCHEMBL2191422 0.73 NR1I2 (0.36) KCNH2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160068523-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds NOVARTIS AG (CH) 2016-03-10 US disclosed
US-7994185-B2 Benzene sulfonamide thiazole and oxazole compounds Glaxo Smith Kline LLC (US) 2011-08-09 US disclosed
US-20110172215-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds NOVARTIS AG (CH) 2011-07-14 US disclosed
EP-2282636-A2 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2011-02-16 EP 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 (2 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-20110172215-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds STS, TST, TPST2 KCNH2 1701/4885EGFR 2172/4885MEN1 3639/4885
US-20160068523-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 KCNH2 1701/4885EGFR 2172/4885MEN1 3639/4885

“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.