SCHEMBL14929503

SCHEMBL14929503

NC(=O)c1cc(F)c(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cnc2c(NCC3CC3)cccc2c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 19/20 0.52
▸ MAPK3 P27361 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ KCNH2 Q12809 2/20 0.49
▸ AURKB Q96GD4 2/20 0.49
▸ GP6 Q9HCN6 1/20 0.49
▸ FER P16591 1/20 0.49

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
SCHEMBL14929307 0.91 FER (0.49) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14909173 0.90 SYK (0.52) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14908739 0.90 FER (0.53) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14929367 0.90 SYK (0.52) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14909170 0.90 SYK (0.52) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14908737 0.90 FER (0.53) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14923756 0.89 SYK (0.48) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14931149 0.89 SYK (0.48) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14909606 0.89 SYK (0.56) SYKMAPK3MAPK1KCNH2AURKB
SCHEMBL14909607 0.89 SYK (0.56) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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

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.

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