SCHEMBL16164417

SCHEMBL16164417

CC(=O)c1cc(Nc2nc(N[C@@H]3CCCC[C@@H]3NC(=O)O)c(F)cc2C#N)cnc1C

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FER P16591 6/20 0.47
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ JAK2 O60674 3/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ JAK1 P23458 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HCRTR1 O43613 1/20 0.34
▸ PKM P14618 1/20 0.34

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
SCHEMBL16164104 0.91 FER (0.46) FERSMN1; SMN2JAK2JAK3JAK1
SCHEMBL16165226 0.91 FER (0.45) FERJAK2JAK3JAK1HCRTR1
SCHEMBL16164477 0.90 FER (0.44) FERSMN1; SMN2JAK2JAK1KDM4E
SCHEMBL16169224 0.89 FER (0.43) FERJAK2JAK1ALDH1A1
SCHEMBL16164910 0.86 FER (0.45) FERJAK2JAK3JAK1HCRTR1
SCHEMBL16165869 0.86 FER (0.41) FERALDH1A1KDM4EMEN1MAPK1
SCHEMBL16165750 0.86 FER (0.46) FERMAPK1
SCHEMBL16164809 0.83 FER (0.48) FERJAK2JAK3JAK1KDM4E
SCHEMBL9110153 0.83 FER (0.44) FERJAK2JAK3JAK1
SCHEMBL9110170 0.83 FER (0.44) FERJAK2JAK3JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 441/4885HTT 4399/4885SMN1; SMN2 2614/4885

“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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