SCHEMBL9407489

SCHEMBL9407489

CCCCN(CCCC)CC(C)CN(CCCC)CCCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PLA2G1B P04054 1/20 0.37
PLA2G2A P14555 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA9 Q16790 2/20 0.36
MAPT P10636 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
DNM1 Q05193 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
ACE2 Q9BYF1 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
SCHEMBL24522571 0.90 KDM4E (0.35) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL21666120 0.85 KDM4E (0.33) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL11597643 0.85 PLA2G1B (0.36) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL8494595 0.85 KDM4E (0.33) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL3099190 0.85 TSHR (0.42) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL28139254 0.84 PLA2G1B (0.34) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL1099979 0.83 MAPK1 (0.39) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL9407528 0.82 HRH3 (0.32) MAPK1PLA2G1BPLA2G2ACA12CA9
SCHEMBL3100149 0.82 KDM4E (0.35) KDM4EMAPK1TDP1PLA2G1BPLA2G2A
SCHEMBL8494696 0.82 PLA2G1B (0.34) KDM4EMAPK1TDP1PLA2G1BPLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0590419-A1 Process for preparing unsaturated amines BASF Aktiengesellschaft (DE) 1994-04-06 EP disclosed