SCHEMBL895259

SCHEMBL895259

CS(=O)(=O)c1ccc(Nc2nc(N3CCCC4(CC(c5ccccc5)=NO4)C3)ccc2C(N)=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.39
BTK Q06187 6/20 0.38
LCK P06239 2/20 0.38
JAK3 P52333 2/20 0.38
EGFR P00533 1/20 0.38
JAK2 O60674 8/20 0.38
JAK1 P23458 8/20 0.38
CAMK1D Q8IU85 1/20 0.38
TYK2 P29597 1/20 0.37
KCNH2 Q12809 1/20 0.37
CSF1R P07333 1/20 0.36
LRRK2 Q5S007 1/20 0.36

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
SCHEMBL893987 0.77 LCK (0.53) SYKBTKLCKJAK3EGFR
SCHEMBL10169304 0.65 SYK (0.52) SYKJAK3JAK2JAK1TYK2
SCHEMBL893867 0.64 SYK (0.51) SYKJAK3EGFRJAK2JAK1
SCHEMBL10210780 0.64 CHRNB4 (0.55)
SCHEMBL895701 0.63 SCD5 (0.48)
SCHEMBL16801848 0.63 JAK3 (0.73) BTKLCKJAK3EGFR
SCHEMBL893657 0.62 CAMK1D (0.44) BTKCAMK1DKCNH2
SCHEMBL2026612 0.62 JAK2 (0.57) JAK2JAK1TYK2
SCHEMBL10168605 0.61 CHRNB4 (0.52)
SCHEMBL5012889 0.61 TRPV1 (0.50)

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 SYK 22/4885BTK 2/4885LCK 31/4885

“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.