SCHEMBL363624

SCHEMBL363624

O=C(O)NNC(=O)NCCN1CCNC1=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
RAB9A P51151 1/20 0.56
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 1/20 0.53
CREBBP Q92793 1/20 0.43
FPR3 P25089 4/20 0.40
FPR2 P25090 4/20 0.40
ENPP2 Q13822 1/20 0.40
HPGDS O60760 1/20 0.39
GABRA5 P31644 1/20 0.39
TSHR P16473 1/20 0.38
PLAT P00750 1/20 0.38
POLR1A O95602 1/20 0.38

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
SCHEMBL10018688 0.94 KDM4E (0.58) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL15167002 0.88 KDM4E (0.56) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL9167791 0.87 KMT2A (0.60) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL5654310 0.85 KMT2A (0.62) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL10018787 0.84 KMT2A (0.52) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL15187483 0.83 KMT2A (0.62) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL13853727 0.81 KMT2A (0.59) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL17428293 0.79 KMT2A (0.58) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL13831072 0.78 KMT2A (0.55) KMT2ARAB9AKDM4EALDH1A1LMNA
SCHEMBL20016690 0.78 KMT2A (0.57) KMT2ARAB9AKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593438-B1 MOLECULES HAVING COMBINABLE GROUPS ARKEMA FRANCE (FR) 2017-09-06 EP disclosed
WO-2016207260-A1 METHOD FOR SYNTHESIZING AZODICARBONYL MOLECULES HAVING ASSOCIATIVE GROUPS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2016-12-29 WO disclosed
EP-2593487-B1 POLYMERS CRAFTED WITH ASSOTIATIVE AZOTIC MOLECULES MICHELIN & CIE (FR) 2015-11-25 EP disclosed
EP-2593487-A1 POLYMERS CRAFTED WITH ASSOTIATIVE AZOTIC MOLECULES Compagnie Générale des Etablissements Michelin (FR) 2013-05-22 EP disclosed
WO-2012007443-A1 GRAFT POLYMER TO WHICH COMBINED NITROGEN MOLECULES ARE GRAFTED SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2012-01-19 WO disclosed