SCHEMBL894905

SCHEMBL894905

CN1CCN(c2ccc(Nc3nc(-c4ccncc4C(N)=O)c(F)cc3C(N)=O)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.52
BRD4 O60885 4/20 0.51
BTK Q06187 2/20 0.48
FLT3 P36888 1/20 0.48
CCNA2 P20248 2/20 0.47
CDK2 P24941 2/20 0.47
CCNA1 P78396 2/20 0.47
STAT6 P42226 1/20 0.47
INSR P06213 1/20 0.47
ALK Q9UM73 1/20 0.47
SLC2A1 P11166 2/20 0.46
JAK2 O60674 2/20 0.46
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45

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
SCHEMBL894903 0.88 BTK (0.49) SYKBRD4BTKFLT3CCNA2
SCHEMBL10169338 0.83 SYK (0.52) SYKBRD4BTKFLT3CCNA2
SCHEMBL894971 0.83 SYK (0.52) SYKBRD4BTKFLT3CCNA2
SCHEMBL893537 0.81 SYK (0.52) SYKBRD4BTKFLT3CCNA2
SCHEMBL10169167 0.75 SYK (0.56) SYKBRD4BTKFLT3CCNA2
SCHEMBL10169371 0.74 STAT6 (0.55) SYKSTAT6ALK
SCHEMBL25562025 0.72 RET (0.70) SYKFLT3CDK2ALKCDK4
SCHEMBL894840 0.72 STAT6 (0.55) SYKSTAT6JAK2
SCHEMBL10169425 0.72 FLT3 (0.55) SYKBRD4BTKFLT3ALK
SCHEMBL894714 0.72 SYK (0.55) SYKBRD4FLT3CCNA2CDK2

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 5 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
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 SYK 22/4885BRD4 271/4885BTK 2/4885

“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.