SCHEMBL10669690

SCHEMBL10669690

C=CCNC(=O)c1cnccn1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.56
KDM4E B2RXH2 2/20 0.54
HPGD P15428 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP2C9 P11712 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP3A4 P08684 1/20 0.50
LMNA P02545 1/20 0.50
PKM P14618 1/20 0.50
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49

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
SCHEMBL509136 0.81 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL10674362 0.77 KDM4E (0.67) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL2215871 0.77 KDM4E (0.67) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL28092442 0.77 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL10668907 0.77 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL10671618 0.77 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL28799522 0.77 SMN1; SMN2 (0.58) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL4453572 0.76 SMN1; SMN2 (0.59) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL30096625 0.75 KDM4E (0.60) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19
SCHEMBL6642124 0.75 SMN1; SMN2 (0.56) SMN1; SMN2KDM4EHPGDCYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024240748-A1 IMPROVED METHOD FOR THE FORMATION OF AMIDES BASF SE (DE) 2024-11-28 WO disclosed
US-4782074-A Fungicidal N,N-disubstituted-heterocyclic carboxamides CHEVRON RESEARCH COMPANY (US) 1988-11-01 US disclosed
US-4654346-A Fungicidal N,N-disubstituted-heterocyclic carboxamides CHEVRON RESEARCH COMPANY (US) 1987-03-31 US disclosed
US-4504484-A Certain N,N-di-substituted-pyridine carboxamides, fungicidal compositions and fungicidal method of use CHEVRON RESEARCH COMPANY (US) 1985-03-12 US disclosed