SCHEMBL14908642

SCHEMBL14908642

O=C(O)N(Cc1ccccc1)c1cncc(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 3/20 0.49
GAA P10253 1/20 0.49
HTT P42858 2/20 0.46
ALOX15 P16050 1/20 0.46
POLB P06746 3/20 0.45
TSPO P30536 1/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 1/20 0.43
GLA P06280 1/20 0.43
RAB9A P51151 1/20 0.43
PAX8 Q06710 1/20 0.43
MAPK1 P28482 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
CASP3 P42574 1/20 0.41
PDK1 Q15118 1/20 0.40

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
SCHEMBL1925718 0.80 RAB9A (0.51) SMN1; SMN2TSHRGAAHTTTSPO
SCHEMBL16633420 0.80 POLB (0.49) SMN1; SMN2TSHRGAAHTTALOX15
SCHEMBL28807373 0.78 GAA (0.70) SMN1; SMN2TSHRGAAHTTPOLB
SCHEMBL14909174 0.77 GAA (0.51) SMN1; SMN2TSHRGAAHTTPOLB
SCHEMBL5907003 0.77 ALDH1A1 (0.54) SMN1; SMN2TSHRGAAHTTTSPO
SCHEMBL15367464 0.77 POLB (0.46) SMN1; SMN2TSHRGAAHTTALOX15
SCHEMBL19019616 0.76 SMN1; SMN2 (0.40) SMN1; SMN2TSHRHTTALOX15POLB
SCHEMBL15367167 0.75 POLB (0.40) SMN1; SMN2TSHRHTTALOX15POLB
SCHEMBL1927016 0.74 ALDH1A1 (0.69) SMN1; SMN2TSHRGAAHTTTSPO
SCHEMBL14809922 0.74 TSHR (0.47) SMN1; SMN2TSHRGAAHTTPOLB

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 SMN1; SMN2 2190/4885TSHR 1886/4885GAA 3096/4885

“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.