SCHEMBL252441

SCHEMBL252441

c1ccc(-c2cc[nH]n2)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.61
LMNA P02545 3/20 0.61
CCR1 P32246 3/20 0.61
CCR5 P51681 3/20 0.61
CCR8 P51685 3/20 0.61
CYP1A2 P05177 1/20 0.61
POLB P06746 1/20 0.61
METAP1 P53582 1/20 0.61
BLM P54132 1/20 0.61
HIF1A Q16665 1/20 0.61
DOHH Q9BU89 1/20 0.61
P4HTM Q9NXG6 1/20 0.61
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
TP53 P04637 3/20 0.52
ALOX15 P16050 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
HTT P42858 2/20 0.52

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
SCHEMBL29429423 1.00 KDM4E (0.61) KDM4ELMNACCR1CCR5CCR8
SCHEMBL27967128 0.98 KDM4E (0.58) KDM4ELMNACCR1CCR5CCR8
Pyrazole SCHEMBL27883203 0.89 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2454750 0.89 LMNA (0.48) KDM4ELMNACCR1CCR5CCR8
Quinoline SCHEMBL28142959 0.86 ALDH1A1 (0.55) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL6408082 0.81 KDM4E (0.93) KDM4ELMNACCR1CCR5CCR8
SCHEMBL1673128 0.78
Dipyridyl SCHEMBL29907716 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29351528 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL3711450 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8

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 1029 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025111482-A1 COMPLEXING AGENT SALT FORMULATIONS OF PHARMACEUTICAL COMPOUNDS AT LOW STOICHIOMETRIC RATIOS BEXSON BIOMEDICAL, INC. (US) 2025-05-30 WO claimed
US-12256735-B2 Insecticidal combinations UPL LTD (IN) 2025-03-25 US claimed
CN-118923682-A Application of compound as inhibitor of pathogenic fungi Pmk1 中国农业大学 2024-11-12 CN claimed
US-20240043399-A1 PYRIDINYL PYRAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2024-02-08 US claimed
CN-117186063-A Ligand and preparation method and application thereof 中南大学 2023-12-08 CN claimed
US-20230292753-A1 AN INSECTICIDAL COMPOSITION FOR PEST CONTROL COMPRISING OF DIACYLHYDRAZINES RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2023-09-21 US claimed
CN-116768853-A Method for preparing pyridylpyrazole acyl chloride from pyridylpyrazole aldehyde and application of method 沈阳中化农药化工研发有限公司 2023-09-19 CN claimed
CN-115968891-A Pesticidal compositions comprising pyridylpyrazole insecticides 江苏龙灯化学有限公司 2023-04-18 CN claimed
US-20230056324-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2023-02-23 US claimed
CN-111269225-B Pyrazole derivative containing pyridyl pyrazole structural unit and preparation method and application thereof 南通大学 2022-12-27 CN claimed
CN-1257490-A Substituted pyridylpyrazoles as herbicides, insecticides and acaricides BAYER AG (DE) 2000-06-21 CN claimed
EP-0983261-A1 SUBSTITUTED PYRIDYLPYRAZOLES AS HERBICIDES, INSECTICIDES AND ACARICIDES Bayer Aktiengesellschaft (DE) 2000-03-08 EP claimed
EP-0944641-A1 NON-HELICAL SUPRAMOLECULAR NANOSYSTEMS Nanogen Recognomics GmbH (DE) 1999-09-29 EP claimed
US-5939441-A Substituted pyridylpyrazoles BAYER AKTIENGESELLSCHAFT (DE) 1999-08-17 US claimed
CN-1208036-A Pesticidal 1-(2-pyridyl) pyrazoles RHONE POULENC AGROCHIMIE (FR) 1999-02-17 CN claimed
WO-1998052938-A1 SUBSTITUTED PYRIDYLPYRAZOLES AS HERBICIDES, INSECTICIDES AND ACARICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-11-26 WO claimed
WO-1998025943-A1 NON-HELICAL SUPRAMOLECULAR NANOSYSTEMS AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) 1998-06-18 WO claimed
CN-1125727-A Substituted pyridylpyrazole compound BAYER AG (DE) 1996-07-03 CN claimed
EP-0679650-A1 Substituted pyridylpyrazoles BAYER AG (DE) 1995-11-02 EP claimed
EP-0389189-A2 Diazepine antiallergy agents Pfizer Limited (GB) 1990-09-26 EP 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 (2 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-20240043399-A1 PYRIDINYL PYRAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF PLK1, PLK2, PLK3 KDM4E 2898/4885LMNA 2062/4885CCR1 4310/4885
US-20230056324-A1 METAL COMPLEXES MCU, IMMT, SOD1 KDM4E 4474/4885LMNA 4719/4885CCR1 2660/4885

“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.