SCHEMBL8942382

SCHEMBL8942382

NC(=O)NCCN(O)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 2/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45
MAOB P27338 1/20 0.45
MEN1 O00255 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
NPC1 O15118 2/20 0.42
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
GSK3B P49841 1/20 0.41

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
SCHEMBL8942623 0.82 HPGD (0.46) ALDH1A1KDM4EMAPTNPC1GSK3B
SCHEMBL8942653 0.81 CA1 (0.47) CYP1A2KMT2AKDM4ENPC1
SCHEMBL8942712 0.80 PARP14 (0.45) MEN1KMT2A
SCHEMBL8942817 0.79 GAA (0.42) MEN1KMT2AKDM4EMAPT
SCHEMBL8942484 0.79 PARP10 (0.50) MEN1KMT2AALDH1A1NPC1
SCHEMBL8782677 0.78 CYP1A2 (0.61) CYP2C19CYP1A2TSHRNFKB1MAOB
SCHEMBL8942432 0.76 RAB9A (0.46) TSHRMEN1KMT2ANPC1
SCHEMBL8942600 0.76 KDM4E (0.46) CYP2C9CYP2C19MEN1KMT2AALDH1A1
SCHEMBL8942383 0.76 ALDH1A1 (0.45) CYP2C9CYP2C19ALDH1A1KDM4EMAPT
SCHEMBL8942408 0.75 TNKS (0.39) MEN1KMT2AALDH1A1LMNAMAPT

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-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed