SCHEMBL894675

SCHEMBL894675

NC(=O)c1cc(F)c(C2=CC(NC(=O)Nc3nccs3)CCC2)nc1Nc1ccc(N2CCOCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 2/20 0.43
SYK P43405 6/20 0.42
EML4 Q9HC35 1/20 0.41
ALK Q9UM73 1/20 0.41
STAT6 P42226 9/20 0.40
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38
BTK Q06187 2/20 0.38

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
SCHEMBL894829 1.00 MAPKAPK5 (0.43) MAPKAPK5SYKEML4ALKSTAT6
SCHEMBL894673 1.00 MAPKAPK5 (0.43) MAPKAPK5SYKEML4ALKSTAT6
SCHEMBL894522 0.81 SYK (0.51) MAPKAPK5SYKEML4ALKSTAT6
SCHEMBL893981 0.74 STAT6 (0.49) MAPKAPK5SYKEML4ALKSTAT6
SCHEMBL10169371 0.70 STAT6 (0.55) MAPKAPK5SYKEML4ALKSTAT6
SCHEMBL894840 0.70 STAT6 (0.55) MAPKAPK5SYKSTAT6
SCHEMBL14909255 0.66 SYK (0.72) SYKEML4ALK
SCHEMBL20750874 0.66 SYK (0.59) SYKEML4ALKSTAT6BTK
SCHEMBL14928870 0.66 SYK (0.72) SYKEML4ALK
SCHEMBL5027969 0.66 SYK (0.72) SYKEML4ALK

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-2440204-B1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL MYERS SQUIBB CO (US) 2013-12-18 EP disclosed
US-8586751-B2 Nicotinamide compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-11-19 US disclosed
EP-2440204-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS Bristol-Myers Squibb Company (US) 2012-04-18 EP disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 US disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 US disclosed
WO-2010144647-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-16 WO disclosed
WO-2010144647-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-16 WO 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-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS NADK, BTK, NAMPT MAPKAPK5 153/4885SYK 22/4885EML4 4878/4885

“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.