SCHEMBL7102012

SCHEMBL7102012

CC(C)CCCC(=O)NN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.50
PHF8 Q9UPP1 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
KDM4E B2RXH2 1/20 0.44
KDM5C P41229 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 2/20 0.39
ENPEP Q07075 1/20 0.38
KDM4C Q9H3R0 2/20 0.38
KDM4A O75164 1/20 0.38
BLM P54132 1/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
DEGS1 O15121 1/20 0.37
KDM1A O60341 1/20 0.37
PLA2G10 O15496 1/20 0.37

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
Hydrochloric Acid SCHEMBL742050 0.98 CTSD (0.48) CTSDPHF8KDM2AKDM4EKDM5C
SCHEMBL406688 0.93 CTSD (0.48) CTSDPHF8KDM2AKDM4EKDM5C
SCHEMBL11573513 0.91 ALDH1A1 (0.50) CTSDPHF8KDM2AKDM4EKDM5C
SCHEMBL2828707 0.86
SCHEMBL28063028 0.84 CTSD (0.48) CTSDPHF8KDM2AKDM4EKDM5C
SCHEMBL11653052 0.84 CTSD (0.48) CTSDPHF8KDM2AKDM4EKDM5C
Hydrochloric Acid SCHEMBL6942259 0.84 CTSD (0.52) CTSDPHF8KDM2AKDM4EKDM5C
SCHEMBL24311924 0.82 LMNA (0.54) CTSDALDH1A1GAALMNAPKM
SCHEMBL5275835 0.79 HDAC3 (0.56) PHF8KDM2AKDM4EKDM5CCA1
SCHEMBL13223739 0.79 LMNA (0.44) PHF8KDM2ACA1KDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1135363-B1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES GREAT LAKES CHEMICAL EUROP (CH) 2003-09-24 EP claimed
US-6444848-B1 REACTING HYDRAZINE WITH ACID CHLORIDE GREAT LAKES CHEMICAL (EUROPE) GMBH (DE) 2002-09-03 US claimed
EP-1135363-A1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES Great Lakes Chemical (Europe) GmbH (CH) 2001-09-26 EP claimed
WO-2000034227-A1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2000-06-15 WO claimed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
EP-1135363-B1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES GREAT LAKES CHEMICAL EUROP (CH) 2003-09-24 EP disclosed
US-6444848-B1 REACTING HYDRAZINE WITH ACID CHLORIDE GREAT LAKES CHEMICAL (EUROPE) GMBH (DE) 2002-09-03 US disclosed
EP-1135363-A1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES Great Lakes Chemical (Europe) GmbH (CH) 2001-09-26 EP disclosed
WO-2000034227-A1 PROCESS FOR THE PREPARATION OF SYMMETRICAL DIACYLHYDRAZINES GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2000-06-15 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 (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-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF CYP3A7, CYP2C19, CYP3A5 CTSD 3042/4885PHF8 1287/4885KDM2A 4218/4885

“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.