SCHEMBL14909017

SCHEMBL14909017

CNc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)c(F)cc2C(N)=O)cn1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.56
MAPK3 P27361 3/20 0.54
MAPK1 P28482 3/20 0.54
KCNH2 Q12809 3/20 0.54
AURKB Q96GD4 3/20 0.54
FER P16591 2/20 0.53
GP6 Q9HCN6 1/20 0.51

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
SCHEMBL14929257 1.00 SYK (0.56) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL3362107 1.00 SYK (0.56) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14908699 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14929589 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL15856004 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14923790 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14908700 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL10250818 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL3387186 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14910022 0.89 SYK (0.58) SYKMAPK3MAPK1KCNH2AURKB

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 10 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-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8772320-B2 2014-07-08 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 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 1/4885MAPK3 559/4885MAPK1 334/4885

“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.