SCHEMBL14909174

SCHEMBL14909174

C=C(C)c1cncc(N(Cc2ccccc2)C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
TSHR P16473 2/20 0.51
TSPO P30536 1/20 0.46
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
GRM2 Q14416 2/20 0.41
HTT P42858 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PAX8 Q06710 2/20 0.39
GLA P06280 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
JAK2 O60674 1/20 0.39

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
SCHEMBL14908642 0.77 SMN1; SMN2 (0.49) GAATSHRTSPOALDH1A1HTT
SCHEMBL3511819 0.75 KDM4E (0.53) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL28807373 0.73 GAA (0.70) GAATSHRALDH1A1KMT2AKDM4E
SCHEMBL1927016 0.70 ALDH1A1 (0.69) GAATSHRTSPOALDH1A1KMT2A
SCHEMBL22289326 0.69 GAA (0.73) GAATSHRALDH1A1KMT2AGRM2
SCHEMBL7778393 0.69 TSPO (0.62) GAATSHRTSPOALDH1A1KMT2A
SCHEMBL28986105 0.68 NPC1 (0.61) GAATSHRTSPOALDH1A1KMT2A
SCHEMBL13571398 0.68 TSHR (0.84) GAATSHRKMT2AMEN1GRM2
SCHEMBL28078011 0.67 NPC1 (0.56) GAATSHRTSPOALDH1A1KMT2A
SCHEMBL3509306 0.67 HCAR2 (0.59) GAATSHRALDH1A1KMT2AKDM4E

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 GAA 3096/4885TSHR 1886/4885TSPO 4397/4885

“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.