SCHEMBL536074

SCHEMBL536074

Clc1c[c]n(-c2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HTT P42858 2/20 0.38
KDM4E B2RXH2 4/20 0.35
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 4/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
BLM P54132 1/20 0.33
CASP9 P55211 1/20 0.33
CASP6 P55212 1/20 0.33
CASP8 Q14790 1/20 0.33
ATM Q13315 1/20 0.33
NPC1 O15118 5/20 0.32
RAB9A P51151 5/20 0.32
PAX8 Q06710 2/20 0.31
MITF O75030 1/20 0.31

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
SCHEMBL535336 0.77 KDM4E (0.37) HTTKDM4EHPGDMEN1KMT2A
SCHEMBL535413 0.76 MAPK14 (0.40) LMNAALDH1A1HTTKDM4EMEN1
SCHEMBL356155 0.75 MAPK1 (0.40) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL535505 0.75 KDM4E (0.35) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL536187 0.75 KDM4E (0.35) KDM4EHPGDMEN1KMT2AGAA
SCHEMBL535473 0.73 TDP1 (0.42) ALDH1A1HTTKDM4EHPGDSMN1; SMN2
SCHEMBL536133 0.71 PTGS1 (0.44) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL6168172 0.71 GRN (0.41) ALDH1A1KDM4EHPGDSMN1; SMN2ATM
SCHEMBL16446689 0.69 NPC1 (0.41) LMNAKDM4EHPGDSMN1; SMN2MEN1
SCHEMBL536052 0.68 TRPA1 (0.35) LMNAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101580489-B Nitrogenous heterocyclic ring compound and preparation method and application thereof SINOCHEM GROUP CO LTD 2011-07-20 CN claimed
CN-101580489-A Nitrogenous heterocyclic ring compound and preparation method and application thereof SINOCHEM CORP (CN) 2009-11-18 CN claimed
EP-0335636-A1 Antiviral compounds SYNPHAR LABORATORIES INC. (CA) 1989-10-04 EP claimed
CN-101628881-B Substituted cyanoacetate compound and application thereof SINOCHEM CORP 2012-11-14 CN disclosed
US-8247431-B2 Heterocyclic hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
EP-2144898-B1 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2012-02-08 EP disclosed
CN-101580489-B Nitrogenous heterocyclic ring compound and preparation method and application thereof SINOCHEM GROUP CO LTD 2011-07-20 CN disclosed
US-7968573-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 US disclosed
EP-1937664-B1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2011-06-15 EP disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 US disclosed
US-7867949-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-11 US disclosed
EP-2251336-A1 Hydrazide compounds as intermediates of pesticides Sumitomo Chemical Company, Limited (JP) 2010-11-17 EP disclosed
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100137362-A1 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 US disclosed
CN-101628881-A Substituted cyanoacetate compound and application thereof SINOCHEM CORP 2010-01-20 CN disclosed
CN-101580489-A Nitrogenous heterocyclic ring compound and preparation method and application thereof SINOCHEM CORP (CN) 2009-11-18 CN disclosed
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-16 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 (5 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-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC1, UQCRC2, Q6ZSR9 LMNA 3620/4885ALDH1A1 280/4885HTT 791/4885
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, H1-2, H1-0 LMNA 2981/4885ALDH1A1 238/4885HTT 364/4885
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC2, UQCRC1, UQCRB LMNA 3234/4885ALDH1A1 217/4885HTT 836/4885
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same ACHE, DDT, CAT LMNA 4343/4885ALDH1A1 436/4885HTT 499/4885
US-20100137362-A1 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, CAT, DNPH1 LMNA 3561/4885ALDH1A1 719/4885HTT 611/4885

“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.