SCHEMBL601922

SCHEMBL601922

O=C(Nc1ccccc1)c1cn[nH]c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.59
ROCK2 O75116 1/20 0.58
PIM1 P11309 1/20 0.56
PIM3 Q86V86 1/20 0.56
PIM2 Q9P1W9 1/20 0.56
HTT P42858 1/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
PTPN1 P18031 3/20 0.55
SIRT1 Q96EB6 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
P4HTM Q9NXG6 1/20 0.53
NAMPT P43490 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
JAK2 O60674 1/20 0.51
TYK2 P29597 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
SCHEMBL4888537 0.84 KDM4E (0.65) ROCK1ROCK2PIM1PIM3PIM2
SCHEMBL2730773 0.84 PIM1 (0.72) PIM1PIM3PIM2HTTNPC1
SCHEMBL28304288 0.83 RAB9A (0.62) ROCK1ROCK2PIM1PIM3PIM2
SCHEMBL18843417 0.83 NPC1 (0.57) ROCK1NPC1RAB9APTPN1P4HTM
SCHEMBL259311 0.81 MEN1 (0.65) HTTNPC1RAB9AKDM4EALDH1A1
SCHEMBL28350597 0.79 MEN1 (0.60) PIM1HTTNPC1RAB9AALDH1A1
SCHEMBL16671586 0.79 ABL1 (0.51) ROCK1ROCK2PIM1PIM3PIM2
SCHEMBL9720272 0.79 ROCK2 (0.71) ROCK1ROCK2PIM1PIM3PIM2
SCHEMBL20577434 0.78 PIM1 (0.52) ROCK1ROCK2PIM1PIM3PIM2
SCHEMBL17159814 0.78 PIM1 (0.69) ROCK1PIM1PIM3PIM2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025041008-A1 SYNERGISTIC PESTICIDAL COMPOSITION MALHOTRA SUNITA (IN) 2025-02-27 WO claimed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US claimed
US-8115012-B2 Process for preparing difluoromethylpyrazolyl carboxylates BASF SE (DE) 2012-02-14 US claimed
US-20100069646-A1 Process for preparing difluoromethylpyrazolyl carboxylates BASF SE (DE) 2010-03-18 US claimed
EP-2086944-B1 PROCESS FOR PREPARING DIFLUOROMETHYLPYRAZOLYL CARBOXYLATES BASF SE (DE) 2010-01-13 EP claimed
CN-112888682-A Heteroaryl aminoquinolines and analogs 拜耳公司 2021-06-01 CN disclosed
CN-109970654-A A series of substitution 2- phenylpyrazole derivatives and its preparation method and application 郑州大学 2019-07-05 CN disclosed
EP-2496560-B1 PROCESS FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2015-04-22 EP disclosed
EP-2496561-B1 PROCESS FOR PREPARING AMINALE AND THEIR USE FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2014-06-04 EP disclosed
US-8362273-B2 Process for preparing aminale and their use for preparing 1,3-disubstituted pyrazole compounds BASF SE (DE) 2013-01-29 US disclosed
US-8362272-B2 Process for preparing 1,3-disubstituted pyrazole compounds BASF SE (DE) 2013-01-29 US disclosed
EP-2496560-A1 PROCESS FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2012-09-12 EP disclosed
WO-2011054732-A1 PROCESS FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2011-05-12 WO disclosed
WO-2011054733-A1 PROCESS FOR PREPARING AMINALE AND THEIR USE FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2011-05-12 WO disclosed
US-20100069646-A1 Process for preparing difluoromethylpyrazolyl carboxylates BASF SE (DE) 2010-03-18 US disclosed
US-20090203523-A1 Fungicidal Mixtures Made From 1-Methylpyrazol-4-Ylcarboxanilides BASF AKTIENGESSELLSCHFT (DE) 2009-08-13 US disclosed
US-20090123561-A1 Fungicide mixtures based on 1-methyl-pyrazol-4-ylcarboxanilides BASF AKTIENGESELLLSCHAFT (DE) 2009-05-14 US disclosed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US disclosed
US-6414013-B1 KINASE INHIBITORS; ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-07-02 US disclosed
WO-1993011117-A1 PYRAZOLE CARBOXANILIDE FUNGICIDES MONSANTO COMPANY (US) 1993-06-10 WO 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 (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-20100069646-A1 Process for preparing difluoromethylpyrazolyl carboxylates HCN2, HCN3, C9 ROCK1 1722/4885ROCK2 1492/4885PIM1 900/4885
US-20090203523-A1 Fungicidal Mixtures Made From 1-Methylpyrazol-4-Ylcarboxanilides CTRL, CYP4X1, SNU13 ROCK1 3299/4885ROCK2 3809/4885PIM1 1283/4885
US-20090123561-A1 Fungicide mixtures based on 1-methyl-pyrazol-4-ylcarboxanilides CBR3, CBR1, CTRL ROCK1 3256/4885ROCK2 3832/4885PIM1 932/4885
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 ROCK1 4207/4885ROCK2 3702/4885PIM1 1689/4885

“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.