SCHEMBL3560757

SCHEMBL3560757

CCOC(=O)C(Cl)=NNc1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
KYAT1 Q16773 5/20 0.64
ALDH1A1 P00352 5/20 0.61
LMNA P02545 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
MAPT P10636 3/20 0.61
NPSR1 Q6W5P4 3/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
GAA P10253 4/20 0.57
TDP1 Q9NUW8 1/20 0.57
ALOX12 P18054 1/20 0.55
HTT P42858 3/20 0.51
HPGD P15428 3/20 0.51
ATM Q13315 1/20 0.50
ABCB1 P08183 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47

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
SCHEMBL16361794 1.00 MEN1 (0.65) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL3560755 1.00 MEN1 (0.65) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL11767616 0.89 KYAT1 (0.60) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL16730420 0.89 KYAT1 (0.60) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL11767611 0.89 KYAT1 (0.60) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL12266608 0.86 MEN1 (0.64) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL12442232 0.86 MAPT (0.59) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL10410691 0.86 MAPT (0.59) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL19661582 0.86 KYAT1 (0.62) MEN1KMT2AKYAT1ALDH1A1LMNA
SCHEMBL10410692 0.86 MAPT (0.59) MEN1KMT2AKYAT1ALDH1A1LMNA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106543139-B Triazolone compound and application thereof 沈阳中化农药化工研发有限公司 2020-03-17 CN disclosed
CN-104395312-B The Spirocyclic derivatives of 4,5-dihydro-pyrazolo [3,4-c] pyridin-2-ones, its preparation method and application SICHUAN HAISCO PHARMACEUTICAL CO.,LTD. (CN) 2016-04-27 CN disclosed
CN-104395312-A Substituted azabicycles and use thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2015-03-04 CN disclosed
WO-2014202027-A1 SPIROCYCLIC DERIVATIVE OF 4,5-DIHYDROPYRAZOLO[3,4-C]PYRIDINE-2-ONE, PREPARATION METHOD AND USE THEREOF 四川海思科制药有限公司 (CN) 2014-12-24 WO disclosed
US-7745476-B2 1,3,5-trisubstituted 4,5-dihydro-1H-pyrazole derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. (NL) 2010-06-29 US disclosed
EP-1713475-B1 1,3,5-TRISUBSTITUTED 4,5-DIHYDRO-1H-PYRAZOLE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY SOLVAY PHARM BV (NL) 2008-07-30 EP disclosed
EP-1713475-A1 1,3,5-TRISUBSTITUTED 4,5-DIHYDRO-1H-PYRAZOLE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY Solvay Pharmaceuticals B.V. (NL) 2006-10-25 EP disclosed
WO-2005074920-A1 1,3,5-TRISUBSTITUTED 4,5-DIHYDRO-1H-PYRAZOLE DERIVATIVES HAVING CB1-ANTAGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-18 WO disclosed
US-20050171179-A1 1,3,5-trisubstituted 4,5-dihydro-1H-pyrazole derivatives having CB1-antagonistic activity SOLVAY PHARMACEUTICALS B.V. 2005-08-04 US disclosed
US-5091405-A Insecticidal pyrazolines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-02-25 US disclosed
EP-0330678-B1 INSECTICIDAL PYRAZOLINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-24 EP disclosed
EP-0330678-A1 INSECTICIDAL PYRAZOLINES. DU PONT (US) 1989-09-06 EP disclosed
WO-1988006583-A1 INSECTICIDAL PYRAZOLINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-07 WO disclosed
US-4042706-A Novel anti-inflammatory pyrazole derivatives and preparation thereof SCHERING AKTIENGESELLSCHAFT (DT) 1977-08-16 US 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 (1 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-20050171179-A1 1,3,5-trisubstituted 4,5-dihydro-1H-pyrazole derivatives having CB1-antagonistic activity CNR2, CNR1, TBXA2R MEN1 2098/4885KMT2A 3150/4885KYAT1 2807/4885

“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.