SCHEMBL5237489

SCHEMBL5237489

CC(C)(C)OC(=O)N1CCCN(c2cccc([N+](=O)[O-])c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
ALDH1A1 P00352 1/20 0.67
MAPT P10636 1/20 0.67
GPR119 Q8TDV5 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ENPP2 Q13822 8/20 0.51
MET P08581 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
ACHE P22303 1/20 0.48

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
SCHEMBL29660566 1.00 LMNA (0.67) LMNAALDH1A1MAPTGPR119SMN1; SMN2
SCHEMBL985189 0.95 LMNA (0.73) LMNAALDH1A1MAPTGPR119SMN1; SMN2
SCHEMBL30208112 0.95 LMNA (0.73) LMNAALDH1A1MAPTGPR119SMN1; SMN2
SCHEMBL3203878 0.86 MAPT (0.90) LMNAALDH1A1MAPTGPR119SMN1; SMN2
SCHEMBL25317704 0.86 GPR119 (0.59) LMNAALDH1A1MAPTGPR119
SCHEMBL29475535 0.86 GPR119 (0.59) LMNAALDH1A1MAPTGPR119
SCHEMBL6352848 0.84 ALDH1A1 (0.56) LMNAALDH1A1MAPTGPR119MET
SCHEMBL30981331 0.83 ALDH1A1 (0.57) LMNAALDH1A1MAPTGPR119ENPP2
SCHEMBL13926625 0.83 ALDH1A1 (0.57) LMNAALDH1A1MAPTGPR119ENPP2
SCHEMBL29475574 0.83 GPR119 (0.62) LMNAALDH1A1MAPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220347187-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO OPERATING COMPANY LLC 2022-11-03 US disclosed
EP-4013743-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Nuvation Bio Inc. (US) 2022-06-22 EP disclosed
CN-114502536-A Heterocyclic compounds as kinase inhibitors 诺维逊生物股份有限公司 2022-05-13 CN disclosed
WO-2021030623-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2021-02-18 WO disclosed
EP-2840080-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2017-12-06 EP disclosed
EP-2840080-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2017-12-06 EP disclosed
US-9145415-B2 Nitrogen-containing heterocyclic compound or salt thereof FUJIFILM CORPORATION (JP) 2015-09-29 US disclosed
US-9145415-B2 Nitrogen-containing heterocyclic compound or salt thereof FUJIFILM CORPORATION (JP) 2015-09-29 US disclosed
US-9145415-B2 Nitrogen-containing heterocyclic compound or salt thereof FUJIFILM CORPORATION (JP) 2015-09-29 US disclosed
EP-2840080-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF Fujifilm Corporation (JP) 2015-02-25 EP disclosed
EP-2840080-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF Fujifilm Corporation (JP) 2015-02-25 EP disclosed
US-20150045339-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORPORATION (JP) 2015-02-12 US disclosed
US-20150045339-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORPORATION (JP) 2015-02-12 US disclosed
US-20150045339-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORPORATION (JP) 2015-02-12 US disclosed
WO-2013157540-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF 富士フイルム株式会社 (JP) 2013-10-24 WO disclosed
US-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 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 (3 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-20150045339-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FLT3, NPM1, ABL1 LMNA 2941/4885ALDH1A1 2553/4885MAPT 3892/4885
US-20220347187-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS CDK4, CDK6, CDK8 LMNA 3004/4885ALDH1A1 2992/4885MAPT 3156/4885
US-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 LMNA 4549/4885ALDH1A1 1073/4885MAPT 4452/4885

“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.