SCHEMBL10169201

SCHEMBL10169201

CCN(CC)c1ccc(Nc2nc(C)ccc2C(N)=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.51
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
MAPT P10636 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
AHR P35869 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM1A O60341 1/20 0.44
MAPK8 P45983 3/20 0.43
NPY5R Q15761 1/20 0.43
NOX1 Q9Y5S8 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
THRB P10828 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
MCL1 Q07820 1/20 0.42
ATM Q13315 1/20 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
SCHEMBL894686 0.86 SYK (0.50) SYKMEN1KMT2AMAPTNPC1
SCHEMBL10169191 0.79 MAPK8 (0.54) SYKKMT2AMAPTNPC1RAB9A
SCHEMBL10169198 0.77 NPC1 (0.47) SYKMEN1KMT2AMAPTNPC1
SCHEMBL14657443 0.76 SYK (0.70) SYKMAPK8NPY5RZAP70
SCHEMBL10169304 0.76 SYK (0.52) SYKMAPTNPC1RAB9AAHR
SCHEMBL894549 0.74 BTK (0.56) SYK
SCHEMBL894552 0.74 BTK (0.56) SYK
SCHEMBL10168712 0.74 BTK (0.50) SYKGAA
SCHEMBL894691 0.74 BTK (0.55) SYK
SCHEMBL13405484 0.73 NPY5R (0.53) SYKMEN1KMT2AMAPTNPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586751-B2 Nicotinamide compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-11-19 US disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 US 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 22/4885MEN1 3526/4885KMT2A 2299/4885

“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.