SCHEMBL14908841

SCHEMBL14908841

CC(C)(C)N(C(=O)O)C(CN1C(=O)c2ccccc2C1=O)c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 5/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 3/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
CYP1A2 P05177 1/20 0.37
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GRM5 P41594 1/20 0.37

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
SCHEMBL14908840 1.00 KMT2A (0.44) KMT2AMEN1NPC1RAB9ACYP2C19
SCHEMBL14910023 1.00 KMT2A (0.44) KMT2AMEN1NPC1RAB9ACYP2C19
SCHEMBL14910664 0.83 KMT2A (0.49) KMT2AMEN1NPC1RAB9ACYP2C19
SCHEMBL14911308 0.83 KMT2A (0.49) KMT2AMEN1NPC1RAB9ACYP2C19
SCHEMBL14910663 0.83 KMT2A (0.49) KMT2AMEN1NPC1RAB9ACYP2C19
SCHEMBL14909468 0.80 KMT2A (0.42) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL14909470 0.80 KMT2A (0.42) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL14909140 0.79 CYP2C19 (0.47) KMT2AMEN1RAB9ACYP2C19ALDH1A1
SCHEMBL14909142 0.79 CYP2C19 (0.47) KMT2AMEN1RAB9ACYP2C19ALDH1A1
SCHEMBL14909814 0.77 KMT2A (0.54) KMT2AMEN1NPC1RAB9AALDH1A1

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-8772320-B2 2014-07-08 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

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 KMT2A 1162/4885MEN1 2870/4885NPC1 1367/4885

“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.