SCHEMBL255920

SCHEMBL255920

c1cncc(-c2ncno2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.53
CHRNA5 P30532 1/20 0.53
CHRNA4 P43681 1/20 0.53
ALDH1A1 P00352 7/20 0.52
CYP2A6 P11509 5/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
HSD17B10 Q99714 6/20 0.50
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
TP53 P04637 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 4/20 0.50
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
TDO2 P48775 1/20 0.47
PPARA Q07869 2/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL2412341 0.77 RAB9A (0.46) ALDH1A1HSD17B10NPC1RAB9ATP53
SCHEMBL2670835 0.75 TP53 (0.48) ALDH1A1CYP1A2CYP3A4HSD17B10NPC1
SCHEMBL21408767 0.74 S1PR1 (0.41)
SCHEMBL12489671 0.73 HPGDS (0.41) CHRNB2CHRNA4CYP2A6CYP1A2NPC1
SCHEMBL31433160 0.73 HPGDS (0.41) CHRNB2CHRNA4CYP2A6CYP1A2NPC1
SCHEMBL2274986 0.71 NPC1 (0.76) ALDH1A1CYP2A6CYP1A2CYP3A4HSD17B10
SCHEMBL29419014 0.71 CYP2A6 (1.00) ALDH1A1CYP2A6CYP1A2CYP3A4HSD17B10
SCHEMBL120088 0.71 CYP2A6 (1.00) ALDH1A1CYP2A6CYP1A2CYP3A4HSD17B10
SCHEMBL30473120 0.71 CYP2A6 (1.00) ALDH1A1CYP2A6CYP1A2CYP3A4HSD17B10
SCHEMBL31417868 0.71 HSD17B1 (0.44) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090018123-A1 Oxazolidinones Bearing Antimicrobial Activity Composition and Methods of Preparation SINDKHEDKAR MILIND D 2009-01-15 US claimed
EP-1912980-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION Wockhardt Limited (IN) 2008-04-23 EP claimed
WO-2007023507-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION WOCKHARDT LIMITED (IN) 2007-03-01 WO claimed
EP-1503997-A1 CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2005-02-09 EP claimed
WO-2003097617-A1 CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-11-27 WO claimed
US-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF VENTUS THERAPEUTICS U.S., INC. (US) 2025-01-02 US disclosed
US-20210246147-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) Valo Health, LLC 2021-08-12 US disclosed
US-20210214323-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2021-07-15 US disclosed
US-10995078-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2021-05-04 US disclosed
EP-3587406-B1 2-HYDROXY-1-{4-[(4-PHENYLPHENYL)CARBONYL]PIPERAZIN-1-YL}ETHAN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS FATTY ACID SYNTHASE (FASN) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS INC (US) 2021-01-27 EP disclosed
US-20200347025-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2020-11-05 US disclosed
US-10800750-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2020-10-13 US disclosed
US-20110028448-A1 PYRIDINE COMPOUNDS ACTELON PHARMACEUTICALS LTD. (CH) 2011-02-03 US disclosed
EP-2262799-A1 PYRIDINE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2010-12-22 EP disclosed
US-20100168005-A1 Pyridin-3-yl derivatives as immunomodulating agents ACTELION PHARMACEUTICALS LTD. (CH) 2010-07-01 US disclosed
WO-2009109906-A1 PYRIDINE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2009-09-11 WO disclosed
CN-101522670-A Pyridin-3-yl derivatives as immunomodulators ACTELION PHARMACEUTICALS LTD (CH) 2009-09-02 CN disclosed
EP-2069335-A1 PYRIDIN-3-YL DERIVATIVES AS IMMUNOMODULATING AGENTS Actelion Pharmaceuticals Ltd. (CH) 2009-06-17 EP disclosed
WO-2008029370-A1 PYRIDIN-3-YL DERIVATIVES AS IMMUNOMODULATING AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2008-03-13 WO disclosed
EP-0641797-A1 Cephem derivatives and antimicrobial agents containing the same KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1995-03-08 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 (9 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-20200347025-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD CHRNB2 2811/4885CHRNA5 2197/4885CHRNA4 2769/4885
US-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF CGAS, TDP1, CYP11B2 CHRNB2 2274/4885CHRNA5 2983/4885CHRNA4 3362/4885
US-20090018123-A1 Oxazolidinones Bearing Antimicrobial Activity Composition and Methods of Preparation POLL, POLM, POLRMT CHRNB2 4395/4885CHRNA5 4333/4885CHRNA4 3718/4885
US-20210246147-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) NAMPT, NAPRT, NNMT CHRNB2 2395/4885CHRNA5 1070/4885CHRNA4 1706/4885
US-20100168005-A1 Pyridin-3-yl derivatives as immunomodulating agents CD4, FCGRT, CD47 CHRNB2 2853/4885CHRNA5 2532/4885CHRNA4 2482/4885
US-20210214323-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD CHRNB2 3004/4885CHRNA5 2694/4885CHRNA4 3264/4885
US-10995078-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD CHRNB2 2811/4885CHRNA5 2197/4885CHRNA4 2769/4885
US-20110028448-A1 PYRIDINE COMPOUNDS CD47, ICOS, NFATC1 CHRNB2 3946/4885CHRNA5 2302/4885CHRNA4 2022/4885
US-10800750-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD CHRNB2 2811/4885CHRNA5 2197/4885CHRNA4 2769/4885

“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.