SCHEMBL8436295

SCHEMBL8436295

CCCCCCCCCCCCN(CCO)CC(O)CN(CCCCCCCCCCCC)CC(O)CN(CCO)CCCCCCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 1/20 0.39
DNM1 Q05193 3/20 0.37
NPSR1 Q6W5P4 1/20 0.36
PLA2G1B P04054 1/20 0.36
PLA2G2A P14555 1/20 0.36
GGPS1 O95749 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8436177 1.00 KDM4E (0.41) KDM4EMAPK1TDP1LMNAMEN1
SCHEMBL8382119 0.98 KDM4E (0.42) KDM4EMAPK1TDP1LMNAMEN1
SCHEMBL7527973 0.96 KDM4E (0.41) KDM4EMAPK1TDP1LMNAMEN1
SCHEMBL11404921 0.91 USP2 (0.42) KDM4EMAPK1TDP1LMNAMEN1
SCHEMBL9576901 0.89 PLA2G1B (0.44) KDM4EMAPK1TDP1LMNAPLA2G1B
SCHEMBL14833428 0.85 PLA2G1B (0.44) KDM4EMAPK1TDP1LMNAMEN1
SCHEMBL10955128 0.85 PLA2G1B (0.46) KDM4ELMNAMEN1KMT2AALDH1A1
SCHEMBL284394 0.85 PLA2G1B (0.46) KDM4ELMNAMEN1KMT2AALDH1A1
SCHEMBL4432629 0.85 PLA2G1B (0.46) KDM4ELMNAMEN1KMT2AALDH1A1
SCHEMBL10702612 0.85 PLA2G1B (0.46) KDM4ELMNAMEN1KMT2AALDH1A1

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-5929283-A HYDROXY AMINES; LOW IN IRRITATIVENESS TO THE SKIN AND HAIR AND EXCELLENT IN FOAMABILITY, AND CAN GIVE A PLEASANT FEELING TO THE USER'S SKIN KAO CORPORATION (JP) 1999-07-27 US disclosed
US-5801270-A Amine derivative and detergent composition containing the same KAO CORPORATION (JP) 1998-09-01 US disclosed
EP-0740651-B1 AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME KAO CORP (JP) 1998-08-12 EP disclosed