SCHEMBL415690

SCHEMBL415690

C/C=C/c1ccccc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.61
SOS1 Q07889 1/20 0.57
MAOB P27338 1/20 0.56
CYP19A1 P11511 2/20 0.55
RAB9A P51151 4/20 0.54
ALDH1A1 P00352 3/20 0.54
ATM Q13315 2/20 0.54
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
NPSR1 Q6W5P4 1/20 0.51
NPC1 O15118 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
LMNA P02545 2/20 0.50
HSP90AA1 P07900 1/20 0.50
HSD17B10 Q99714 1/20 0.50
AR P10275 1/20 0.50

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
SCHEMBL7527194 1.00 MAPT (0.61) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL7516374 1.00 MAPT (0.61) MAPTSOS1MAOBCYP19A1RAB9A
Bicarbonate SCHEMBL27446001 0.93 MAPT (0.68) MAPTSOS1MAOBRAB9AALDH1A1
SCHEMBL11049170 0.87 MAPT (0.69) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL14935499 0.87 MAPT (0.69) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL9978289 0.87 MAPT (0.69) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL9622795 0.87 SOS1 (0.61) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL9622793 0.87 SOS1 (0.61) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL11296000 0.85 MAPT (0.67) MAPTSOS1MAOBCYP19A1RAB9A
SCHEMBL11299049 0.85 MAPT (0.67) MAPTSOS1MAOBCYP19A1RAB9A

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP claimed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP claimed
US-20180011405-A1 RESIST UNDERLAYER FILM COMPOSITION, PATTERNING PROCESS, METHOD FOR FORMING RESIST UNDERLAYER FILM, AND COMPOUND FOR RESIST UNDERLAYER FILM COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-01-11 US disclosed
US-9328061-B2 Simple organic molecules as catalysts for practical and efficient enantioselective synthesis of amines and alcohols TRUSTEES OF BOSTON COLLEGE (US) 2016-05-03 US disclosed
US-9290484-B2 Furyl and thienyl triazole derivatives and therapeutic uses thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-03-22 US disclosed
US-9290484-B2 Furyl and thienyl triazole derivatives and therapeutic uses thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-03-22 US disclosed
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS ALIOS BIOPHARMA, INC. 2016-02-18 US disclosed
US-20150057451-A1 SIMPLE ORGANIC MOLECULES AS CATALYSTS FOR PRACTICAL AND EFFICIENT ENANTIOSELECTIVE SYNTHESIS OF AMINES AND ALCOHOLS NATIONAL INSTITUTES OF HEALTH, U.S. DEPARTMENT OF HEALTH AND HUMAN SERVICES, U.S. GOVERNMENT 2015-02-26 US disclosed
US-8895497-B2 Cathepsin S inhibitors DCB-USA, LLC (US) 2014-11-25 US disclosed
US-20140243381-A1 FURYL AND THIENYL TRIAZOLE DERIVATIVES AND THERAPEUTIC USES THEREOF UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2014-08-28 US disclosed
US-20140243381-A1 FURYL AND THIENYL TRIAZOLE DERIVATIVES AND THERAPEUTIC USES THEREOF UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2014-08-28 US disclosed
US-20070203236-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE UNITED STATES GOVERNMENT 2007-08-30 US disclosed
US-20070032503-A1 Method of preparation of azaindole derivatives VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2007-02-08 US disclosed
WO-2003035057-A1 INHIBITORS OF DIPEPTIDYL PEPTIDASE IV FERRING B.V. (NL) 2003-05-01 WO disclosed
EP-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP disclosed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed
EP-0350069-B1 METHOD FOR OXIDIZING UNSATURATED AROMATIC COMPOUNDS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
US-4967009-A REACTING UNSATURATED AROMATIC COMPOUNDS WITH AROMATIC IODOSYL COMPOUNDS TO YIELD AROMATIC ALDEHYDES OR KETONES NIPPON PETROCHEMICALS CO., LTD. (JP) 1990-10-30 US disclosed
EP-0350069-A2 Method for oxidizing unsaturated aromatic compounds NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-01-10 EP disclosed
EP-0104863-B1 LIGHT-SENSITIVE PLANOGRAPHIC PRINTING PLATE FUJI PHOTO FILM CO., LTD. (JP) 1989-05-03 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 (5 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-20070203236-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE FADS2, ACOT7, FADS1 MAPT 4500/4885SOS1 3772/4885MAOB 1269/4885
US-20150057451-A1 SIMPLE ORGANIC MOLECULES AS CATALYSTS FOR PRACTICAL AND EFFICIENT ENANTIOSELECTIVE SYNTHESIS OF AMINES AND ALCOHOLS ADH1C, ADH5, ADH1A MAPT 1268/4885SOS1 2864/4885MAOB 10/4885
US-20070032503-A1 Method of preparation of azaindole derivatives TPMT, HAVCR2, CYP3A43 MAPT 3261/4885SOS1 4636/4885MAOB 28/4885
US-20140243381-A1 FURYL AND THIENYL TRIAZOLE DERIVATIVES AND THERAPEUTIC USES THEREOF NOS3, NOS2, NOS1 MAPT 3911/4885SOS1 3422/4885MAOB 343/4885
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS MAVS, EIF2AK2, SARS1 MAPT 4258/4885SOS1 4459/4885MAOB 3969/4885

“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.