SCHEMBL310265

SCHEMBL310265

NC(=O)c1cccnc1N

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.70
PARP1 P09874 1/20 0.58
PRKCI P41743 2/20 0.56
MKNK1 Q9BUB5 1/20 0.53
MKNK2 Q9HBH9 1/20 0.53
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 3/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
AHR P35869 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTT P42858 1/20 0.46
TSHR P16473 2/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
BLM P54132 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
SCHEMBL30901792 1.00 NAPRT (0.70) NAPRTPARP1PRKCIMKNK1MKNK2
Hydrochloric Acid SCHEMBL11788163 0.98 NAPRT (0.68) NAPRTPARP1PRKCIMKNK1MKNK2
2-Aminopyridine SCHEMBL15270616 0.89 NAPRT (0.58) NAPRTPARP1PRKCIMKNK1MKNK2
Propionic Acid SCHEMBL27888844 0.88 NAPRT (0.61) NAPRTPARP1PRKCIMKNK1MKNK2
Carbamic Acid SCHEMBL27881895 0.85 NAPRT (0.96) NAPRTPARP1PRKCIMKNK1MKNK2
SCHEMBL8198020 0.84 NAPRT (0.73) NAPRTPARP1PRKCIMKNK1MKNK2
SCHEMBL28253352 0.83 MKNK1 (0.58) NAPRTPARP1PRKCIMKNK1MKNK2
SCHEMBL31230208 0.83 MKNK1 (0.58) NAPRTPARP1PRKCIMKNK1MKNK2
SCHEMBL11098869 0.83 NAPRT (0.70) NAPRTPARP1PRKCIMKNK1MKNK2
SCHEMBL29530139 0.83 NAPRT (1.00) NAPRTPRKCIKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119776854-A Electrochemical preparation method of adiponitrile 万华化学集团股份有限公司 2025-04-08 CN claimed
CN-119384143-A Preparation method of perovskite solar cell based on nicotinamide derivative material passivation 南开大学 2025-01-28 CN claimed
WO-2024148139-A2 METABOLITE-BASED PARTICLES AND COMPOSITIONS THEREOF FOR PREVENTING AND TREATING NEUROLOGICAL DISEASES AND DISORDERS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2024-07-11 WO claimed
CN-114807988-B Electrode material for synthesizing dialdehyde starch by using electrolytic starch, preparation method of electrode material and electrochemical preparation method of dialdehyde starch 万华化学集团股份有限公司 2024-06-25 CN claimed
EP-3670490-B1 METHOD OF PURIFYING PINE CHEMICAL COMPOSITIONS FROM ALDEHYDES KRATON POLYMERS LLC (US) 2023-01-18 EP claimed
CN-111004284-B Synthesis method and application of polysubstituted 2-aminopyridine derivative 重庆大学 2022-08-05 CN claimed
CN-114807988-A Electrode material for synthesizing dialdehyde starch by electrolyzing starch and preparation method thereof and electrochemical preparation method of dialdehyde starch 万华化学集团股份有限公司 2022-07-29 CN claimed
EP-3670490-A1 METHOD OF PURIFYING PINE CHEMICAL COMPOSITIONS FROM ALDEHYDES Kraton Polymers LLC (US) 2020-06-24 EP claimed
US-20200165191-A1 Method of Purifying Pine Chemical Compositions from Aldehydes KRATON POLYMERS LLC (US) 2020-05-28 US claimed
CN-111004284-A Synthesis method and application of polysubstituted 2-aminopyridine derivative 重庆大学 2020-04-14 CN claimed
CN-101765425-A Use of benzamide derivatives for the treatment of CNS disorders HOFFMANN LA ROCHE 2010-06-30 CN claimed
US-7547713-B2 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives GU LIANQUAN 2009-06-16 US claimed
US-20080167375-A1 TREATMENT OF CUTANEOUS NEUROGENIC INFLAMMATION ASTION PHARMA A/S 2008-07-10 US claimed
WO-2007140791-A1 TREATMENT OF CUTANEOUS NEUROGENIC INFLAMMATION ASTION PHARMA A/S (DK) 2007-12-13 WO claimed
EP-1864657-A1 Treatment of cutaneous neurogenic inflammation Astion Pharma A/S (DK) 2007-12-12 EP claimed
US-20060111405-A1 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives GU LIANQUAN 2006-05-25 US claimed
EP-1560589-A1 NOVEL COMPLEXES OF FATTY ACID ESTERS OF POLYHYDROXYALKANES AND PYRIDINE CARBOXY DERIVATIVES Astion Dermatology A/S (DK) 2005-08-10 EP claimed
US-20040192744-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HAAG RAINER (DE) 2004-09-30 US claimed
WO-2004000333-A1 NOVEL COMPLEXES OF FATTY ACID ESTERS OF POLYHYDROXYALKANES AND PYRIDINE CARBOXY DERIVATIVES ASTION DERMATOLOGY A/S (DK) 2003-12-31 WO claimed
US-20030139404-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2003-07-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20060111405-A1 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives PTGS2, PTGES2, PTGES NAPRT 262/4885PARP1 368/4885PRKCI 2541/4885
US-20040192744-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents NAT1, CYP1A1, UGT1A1 NAPRT 447/4885PARP1 710/4885PRKCI 4606/4885
US-20080167375-A1 TREATMENT OF CUTANEOUS NEUROGENIC INFLAMMATION CUTA, SCD, ALOX15B NAPRT 805/4885PARP1 3795/4885PRKCI 2405/4885
US-20030139404-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents NAT1, CYP1A1, UGT1A1 NAPRT 447/4885PARP1 710/4885PRKCI 4606/4885

“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.