SCHEMBL894733

SCHEMBL894733

NC(=O)c1ccc(N2CCN(C(=O)Cc3ccccc3)CC2)nc1Nc1ccc(C(=O)N2CCOCC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.66
SYK P43405 1/20 0.48
HPGD P15428 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
CSF1R P07333 1/20 0.44
STAT6 P42226 1/20 0.44
CAMK1D Q8IU85 1/20 0.43
EGFR P00533 1/20 0.43
LCK P06239 1/20 0.43

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
SCHEMBL20998489 0.85 BTK (0.76) BTKSYKHPGDRXFP1LCK
SCHEMBL894473 0.84 BTK (0.72) BTKSYKHPGDRXFP1JAK2
SCHEMBL894315 0.78 BTK (0.90) BTKSYKCAMK1D
SCHEMBL894314 0.78 BTK (0.90) BTKSYKCAMK1D
Hydrochloric Acid SCHEMBL16671663 0.78 BTK (0.88) BTKSYKCAMK1D
SCHEMBL10168689 0.77 BTK (0.77) BTKSYKEGFR
SCHEMBL893914 0.77 BTK (0.78) BTKEGFRLCK
SCHEMBL893913 0.77 BTK (0.78) BTKEGFRLCK
SCHEMBL893942 0.76 BTK (0.65) BTKSYKHPGDRXFP1JAK2
SCHEMBL10168754 0.76 BTK (0.68) BTKSYKHPGDRXFP1JAK2

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 2/4885SYK 22/4885HPGD 225/4885

“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.