SCHEMBL9681407

SCHEMBL9681407

NC(=O)NC1(N2C(=O)c3cccc(Cl)c3C2=O)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 6/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 1/20 0.36
HDAC4 P56524 1/20 0.35
APAF1 O14727 1/20 0.34
TDP2 O95551 1/20 0.34
NSD2 O96028 1/20 0.34
ABL1 P00519 1/20 0.34
MAPT P10636 1/20 0.34
GALK1 P51570 1/20 0.34
BLM P54132 1/20 0.34
RIN1 Q13671 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
CYP2C19 P33261 1/20 0.34
HCN4 Q9Y3Q4 1/20 0.34
SLC6A9 P48067 2/20 0.34

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
SCHEMBL5933663 0.81 ALDH1A1 (0.43) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL9681285 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11725862 0.76 ALDH1A1 (0.44) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11728026 0.76 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11728882 0.75 ALDH1A1 (0.43) ALDH1A1KDM4ELMNAHDAC4CYP2C19
SCHEMBL11730202 0.75 ALDH1A1 (0.49) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11731676 0.75 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL11731534 0.72 ALDH1A1 (0.46) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL11727273 0.71 NSD2 (0.36) ALDH1A1KDM4EKMT2AMEN1APAF1
SCHEMBL11612097 0.67 ALDH1A1 (0.38) ALDH1A1KDM4ELMNAAPAF1NSD2

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
US-5102447-A Applying 1-(3-chlorophthalimido)cyclohexanecarboxamide to the roots, seeds, leaves or soil surrounding crops to prevent phytotoxic effects of terbufos AMERICAN CYANAMID COMPANY (US) 1992-04-07 US disclosed