SCHEMBL8437640

SCHEMBL8437640

CCCCN(CC(O)CCl)CC(O)CCl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CA1 P00915 4/20 0.34
CA9 Q16790 3/20 0.34
CA12 O43570 2/20 0.34
HSF1 Q00613 1/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KCNH2 Q12809 1/20 0.33
CA2 P00918 2/20 0.32
PLA2G1B P04054 1/20 0.31
PLA2G2A P14555 1/20 0.31
TSHR P16473 2/20 0.31
ALDH1A1 P00352 2/20 0.31
ALDH2 P05091 1/20 0.30
KDM5A P29375 1/20 0.30

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
SCHEMBL8437206 0.92 DNM1 (0.38) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL8436179 0.90 DNM1 (0.37) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL8616599 0.90 DNM1 (0.37) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL9319048 0.82 KDM4E (0.45) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL29966470 0.81 KDM4E (0.51) KDM4ETDP1MAPK1MEN1KMT2A
Hydrochloric Acid SCHEMBL16323659 0.80 ALDH1A1 (0.37) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL7159866 0.80 KDM4E (0.44) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL20762476 0.78 KDM4E (0.46) KDM4ETDP1MAPK1MEN1KMT2A
SCHEMBL21895706 0.78 HSF1 (0.36) MEN1KMT2ACA1CA9HSF1
SCHEMBL18567086 0.77 KDM4E (0.49) KDM4ETDP1MAPK1MEN1KMT2A

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
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
EP-0740651-A1 AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME Kao Corporation (JP) 1996-11-06 EP disclosed
WO-1995016664-A1 AMINE DERIVATIVE AND DETERGENT COMPOSITION CONTAINING THE SAME KAO CORPORATION (JP) 1995-06-22 WO disclosed