SCHEMBL115478

SCHEMBL115478

NC(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.65
ALDH1A1 P00352 2/20 0.63
PLAU P00749 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
ALPL P05186 1/20 0.50
GAA P10253 1/20 0.50
HTT P42858 1/20 0.50
NCOA1 Q15788 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NCOA3 Q9Y6Q9 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL10766788 1.00 CTSD (0.65) CTSDALDH1A1PLAUCYP1A2CYP3A4
Hydrochloric Acid SCHEMBL10550781 0.98 CTSD (0.62) CTSDALDH1A1PLAUCYP1A2CYP3A4
Hydrochloric Acid SCHEMBL8025084 0.98 CTSD (0.62) CTSDALDH1A1PLAUCYP1A2CYP3A4
Sodium Chloride SCHEMBL9877634 0.93 CTSD (0.57) CTSDALDH1A1PLAUCYP1A2CYP3A4
Aziridine SCHEMBL5805605 0.91 CTSD (0.56) CTSDALDH1A1PLAUCYP1A2CYP3A4
Alcohol SCHEMBL6835144 0.91 CTSD (0.60) CTSDALDH1A1CYP1A2CYP3A4CYP2D6
Monoethanolamine SCHEMBL28409331 0.89 CTSD (0.58) CTSDALDH1A1PLAUCYP1A2CYP3A4
SCHEMBL995083 0.85 LMNA (0.54) CTSDALDH1A1PLAUTDP1MAPT
SCHEMBL29950282 0.85 LMNA (0.54) CTSDALDH1A1PLAUTDP1MAPT
SCHEMBL975117 0.83 ALDH1A1 (0.68) CTSDALDH1A1CYP1A2CYP3A4CYP2D6

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

Appears in 6094 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119824566-A Polyamide-imide composite nanofiber and preparation method thereof 广东坚达聚纤科技实业有限公司 2025-04-15 CN claimed
CN-118852568-A Efficient, green and universal fusion synthesis method for covalent organic frameworks 浙江大学杭州国际科创中心 2024-10-29 CN claimed
US-12060334-B2 3-substituted phenazine derivatives as antimicrobial agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-08-13 US claimed
EP-3715346-B1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES DANA FARBER CANCER INST INC (US) 2024-01-03 EP claimed
EP-4277636-A1 MODIFIED OLIGONUCLEOTIDES Alnylam Pharmaceuticals, Inc. (US) 2023-11-22 EP claimed
EP-3606528-B1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF BROAD INST INC (US) 2023-10-18 EP claimed
WO-2022155418-A9 MODIFIED OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2023-03-09 WO claimed
US-11434301-B2 Anti-CD46 antibodies and methods of use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-09-06 US claimed
EP-3291676-B1 MITRAGYNINE ANALOGS AND USES THEREOF MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-08-17 EP claimed
WO-2022155418-A1 MODIFIED OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2022-07-21 WO claimed
EP-0081726-A1 Nitrobenzoic acid amide derivatives TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1983-06-22 EP claimed
US-4376868-A Alkoxylation of cresylic acids CONOCO INC. (US) 1983-03-15 US claimed
EP-0049358-A1 Strontium and barium containing alkoxylation systems for unsaturated alcohols Conoco Phillips Company (US) 1982-04-14 EP claimed
EP-0046947-A1 Strontium and barium containing alkoxylation systems Conoco Phillips Company (US) 1982-03-10 EP claimed
US-4260540-A SPIN DYEING POLYACRYLONITRILE BAYER AKTIENGESELLSCHAFT (DE) 1981-04-07 US claimed
EP-0023569-A1 Derivatives of carboxylic acids, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 EP claimed
US-4225489-A Heterocyclic azo dyes and pigments containing 4-quinazolinone moieties BAYER AKTIENGESELLSCHAFT (DE) 1980-09-30 US claimed
US-4151165-A USING AN AROMATIC NITRO COMPOUND IN OXYGEN-FREE, AQUEOUS ENVIRONMENT ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1979-04-24 US claimed
US-3943152-A Method for preparing azines PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-03-09 US claimed
US-3943132-A Process for the preparation of hydrazones PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-03-09 US claimed