SCHEMBL14908736

SCHEMBL14908736

COc1cc(Nc2nc(NCC3CC3)c(F)cc2C(N)=O)cc(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.47
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
ZAP70 P43403 7/20 0.41
KARS1 Q15046 4/20 0.41
PRKCQ Q04759 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL14929811 0.94 SYK (0.46) SYKROCK2ROCK1PRKCQ
SCHEMBL14909411 0.87 SYK (0.50) SYKZAP70KARS1
SCHEMBL14909830 0.86 SYK (0.55) SYKZAP70KARS1
SCHEMBL14909813 0.86 SYK (0.49) SYKZAP70KARS1
SCHEMBL14909780 0.84 SYK (0.48) SYKZAP70KARS1
SCHEMBL14909299 0.84 SYK (0.48) SYKZAP70KARS1
SCHEMBL14909018 0.84 SYK (0.54) SYKZAP70KARS1
SCHEMBL3382363 0.83 SYK (0.52) SYKROCK2ROCK1ZAP70KARS1
SCHEMBL14908592 0.83 SYK (0.54) SYKZAP70KARS1
SCHEMBL14908594 0.83 SYK (0.54) SYKZAP70KARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2589592-B1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM CORP (JP) 2018-08-22 EP disclosed
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 EP disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 EP 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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK SYK 1/4885ROCK2 1485/4885ROCK1 849/4885

“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.