SCHEMBL9012916

SCHEMBL9012916

O=C(O)N(Cc1ccccc1)[C@@H](CO)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HPGD P15428 1/20 0.46
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALPI P09923 1/20 0.43
PKM P14618 1/20 0.43
PTGS1 P23219 1/20 0.43
XIAP P98170 1/20 0.43
SLC7A5 Q01650 1/20 0.43
TRPA1 O75762 1/20 0.43
MDM2 Q00987 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
GLA P06280 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL6540352 0.91 MEN1 (0.42) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL2268145 0.84 MEN1 (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL18341181 0.84 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL1024207 0.84 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL1642165 0.84 KMT2A (0.51) MEN1KMT2AHPGDALDH1A1LMNA
SCHEMBL18341183 0.84 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL6540317 0.84 TAS2R14 (0.50) MEN1KMT2AL3MBTL1OPRK1
Hydrochloric Acid SCHEMBL4856193 0.83 KMT2A (0.46) MEN1KMT2AHPGDCYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL20974172 0.83 KMT2A (0.46) MEN1KMT2AHPGDCYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL20974171 0.83 KMT2A (0.46) MEN1KMT2AHPGDCYP1A2ALDH1A1

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 7 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
US-5530124-A Method for preparing cyclic ureas and their use for the synthesis of HIV protease inhibitors THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1996-06-25 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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK MEN1 2870/4885KMT2A 1162/4885HPGD 1481/4885

“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.