SCHEMBL893637

SCHEMBL893637

NC(=O)c1cc(F)c(N2CCCCC2)nc1Nc1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.48
ALDH1A1 P00352 1/20 0.46
CAMK1D Q8IU85 1/20 0.44
JAK3 P52333 2/20 0.43
SYK P43405 2/20 0.43
HTR2C P28335 2/20 0.43
HTR2A P28223 1/20 0.43
JAK2 O60674 4/20 0.43
JAK1 P23458 3/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
STAT6 P42226 3/20 0.42

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
SCHEMBL20998656 0.83 BTK (0.50) BTKCAMK1DJAK3SYKJAK2
SCHEMBL10169484 0.82 JAK2 (0.39) BTKALDH1A1SYKJAK2NPC1
SCHEMBL10169541 0.80 BTK (0.40) BTKALDH1A1CAMK1DSYKJAK2
SCHEMBL16798570 0.79 JAK3 (0.43) ALDH1A1JAK3SYKHTR2CHTR2A
SCHEMBL10169403 0.76 SYK (0.44) ALDH1A1SYKJAK2JAK1NPC1
SCHEMBL894667 0.76 MAPK9 (0.47) BTKALDH1A1JAK3SYKJAK2
SCHEMBL20998583 0.75 BTK (0.48) BTKJAK3SYKJAK2JAK1
SCHEMBL10169433 0.73 MEN1 (0.47) BTKALDH1A1CAMK1DJAK3SYK
SCHEMBL894575 0.73 BTK (0.55) BTKCAMK1DJAK3SYK
SCHEMBL9106239 0.71 SYK (0.68) SYK

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 9 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
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
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 BTK 2/4885ALDH1A1 2193/4885CAMK1D 426/4885

“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.