SCHEMBL1013

SCHEMBL1013

NC(=O)OCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.62
RAB9A P51151 1/20 0.60
AKR1C3 P42330 1/20 0.56
LOXL2 Q9Y4K0 1/20 0.53
HTT P42858 1/20 0.52
HTR2A P28223 1/20 0.52
TSHR P16473 1/20 0.52
MAOB P27338 1/20 0.51
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL20497357 0.95 IDO1 (0.57) IDO1RAB9AAKR1C3LOXL2HTT
SCHEMBL11085603 0.92 IDO1 (0.54) IDO1RAB9AAKR1C3HTTHTR2A
Phenylacetic Acid SCHEMBL11792837 0.87 ALDH1A1 (0.57) IDO1RAB9AHTTALDH1A1
SCHEMBL30035120 0.87 RAB9A (0.49) IDO1RAB9AALDH1A1
SCHEMBL37664 0.85 HTR2A (0.62) IDO1RAB9AAKR1C3HTTHTR2A
SCHEMBL29902979 0.85 RAB9A (0.57) IDO1RAB9AAKR1C3ALDH1A1
SCHEMBL6562098 0.84 IDO1 (0.61) IDO1RAB9AAKR1C3LOXL2HTT
SCHEMBL37665 0.84 AKR1C3 (0.62) IDO1RAB9AAKR1C3HTTHTR2A
SCHEMBL6399778 0.84 IDO1 (0.59) IDO1RAB9AAKR1C3LOXL2HTT
SCHEMBL11001927 0.83 IDO1 (0.56) IDO1RAB9AAKR1C3LOXL2HTT

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 3904 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-2970107-B1 PHOTOSWITCHABLE HDAC INHIBITORS MASSACHUSETTS GEN HOSPITAL (US) 2023-11-15 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
EP-3291676-B1 MITRAGYNINE ANALOGS AND USES THEREOF MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-08-17 EP claimed
CN-109963833-B Process for the preparation of mono-protected alpha, omega-diaminoalkanes 拜奥迪斯私人有限公司 2022-02-22 CN claimed
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis THE GENERAL HOSPITAL CORPORATION (US) 2022-02-08 US claimed
EP-3172213-B1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF DANA FARBER CANCER INST INC (US) 2021-09-22 EP claimed
EP-3092220-B1 VITAMIN C PRODRUGS AND USES THEREOF UNIV FLORIDA (US) 2021-01-20 EP claimed
EP-3538510-B1 PROCESS FOR THE PREPARATION OF MONO-PROTECTED ALPHA,OMEGA-DIAMINO ALKANES BYONDIS BV (NL) 2021-01-06 EP claimed
EP-0079167-A1 A carbapenem compound, preparation and use BEECHAM GROUP PLC (GB) 1983-05-18 EP claimed
US-4359472-A DERIVED FROM A PENICILLIN AND A BETA-LACTAMASE INHIBITOR PFIZER INC. (US) 1982-11-16 US claimed
US-4352752-A Process for the preparation of dipeptides SAGAMI CHEMICAL RESEARCH CENTER (JP) 1982-10-05 US claimed
EP-0060119-A1 Azetidinone compounds and their preparation ELI LILLY AND COMPANY (US) 1982-09-15 EP claimed
US-4347181-A Intermediates for producing bicyclic β-lactam-antibiotics BEECHAM GROUP LIMITED (GB) 1982-08-31 US claimed
US-4289696-A BETA-LACTAMASE INHIBITORY AGENTS WHICH ENHANCE ACTIVITY OF A PENICICILLIN OR CEPHALOSPORIN BEECHAM GROUP LIMITED (GB) 1981-09-15 US claimed
EP-0024832-A1 Beta-lactam antibiotics, their preparation, pharmaceutical compositions containing them and their preparation BEECHAM GROUP PLC (GB) 1981-03-11 EP claimed
US-4048163-A Process for preparation of 7-alkoxy-3-chloromethylcephems ELI LILLY AND COMPANY (US) 1977-09-13 US claimed
US-4042585-A Process for preparation of 3-halomethylcephems ELI LILLY AND COMPANY (US) 1977-08-16 US claimed
US-4012380-A 7-Acylamino-3-acyl-2(or 3)cephems ELI LILLY AND COMPANY (US) 1977-03-15 US claimed