SCHEMBL16164237

SCHEMBL16164237

Cc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3NC(=O)O)c(F)cc2C#N)cc1C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FER P16591 9/20 0.50
▸ MAPT P10636 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ SYK P43405 2/20 0.39
▸ GAA P10253 2/20 0.38
▸ GFER P55789 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ JAK2 O60674 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL16165003 0.92 FER (0.48) FERSYKGAANPC1RAB9A
SCHEMBL16164999 0.90 FER (0.51) FERMAPTSYKKDM4EJAK2
SCHEMBL16163934 0.90 FER (0.49) FERMAPTSYKNPC1RAB9A
SCHEMBL16164809 0.89 FER (0.48) FERMAPTSYKKDM4EJAK2
SCHEMBL16169188 0.89 FER (0.46) FERMAPTSYKKDM4EJAK2
SCHEMBL16164243 0.88 FER (0.65) FERSYK
SCHEMBL16165489 0.87 FER (0.47) FERMAPTTP53SYKNPC1
SCHEMBL16165778 0.86 FER (0.54) FERSYKGAANPC1RAB9A
SCHEMBL16165879 0.85 FER (0.56) FERMAPTTP53SYKNPC1
SCHEMBL16163851 0.85 FER (0.53) FERSYKNPC1RAB9AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2799431-B1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORP (JP) 2018-01-24 — — EP disclosed
US-9051310-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2015-06-09 — — US disclosed
EP-2799431-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM Corporation (JP) 2014-11-05 — — EP disclosed
US-20140309225-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2014-10-16 — — 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-20140309225-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, BTK, NOX4 FER 441/4885MAPT 4402/4885TP53 2270/4885

“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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