SCHEMBL9769039

SCHEMBL9769039

NN=Cc1cccnc1Cl

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 12/20 0.45
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
AMY1A P0DUB6 1/20 0.38
MPI P34949 1/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL1202413 0.80 ALDH1A1 (0.47) NFE2L2TRIM24TRIM33LMNASMN1; SMN2
SCHEMBL1202412 0.80 ALDH1A1 (0.47) NFE2L2TRIM24TRIM33LMNASMN1; SMN2
2-Chloronicotinaldehyde SCHEMBL715765 0.79
2-Chloronicotinaldehyde SCHEMBL29828177 0.79
Hydrochloric Acid SCHEMBL4048083 0.78 ALDH1A1 (0.46) NFE2L2TRIM24TRIM33LMNASMN1; SMN2
SCHEMBL25926289 0.78 AMY1A (0.59) TRIM24TRIM33AMY1ALMNASMN1; SMN2
SCHEMBL4638902 0.77 NFE2L2 (0.40) NFE2L2TRIM24TRIM33LMNASMN1; SMN2
SCHEMBL22925143 0.76 PKM (0.44) NFE2L2LMNASMN1; SMN2KMT2AKDM4E
2-Chloronicotinaldehyde SCHEMBL30893972 0.73 TRIM24 (0.53) NFE2L2TRIM24TRIM33LMNASMN1; SMN2
SCHEMBL30114987 0.73 KDM4E (0.49) LMNASMN1; SMN2KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5011932-A Anthelmintic pyridinyl acylhydrazones derivatives UPJOHN COMPANY (US) 1991-04-30 US claimed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 EP claimed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 WO claimed