SCHEMBL14624644

SCHEMBL14624644

Cc1[nH]c(=O)c(C(=O)Nc2ncc(Br)cn2)c(O)c1F

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.35
XDH P47989 8/20 0.34
SLC22A12 Q96S37 2/20 0.34
KDM5A P29375 3/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NLRP3 Q96P20 1/20 0.32
HIF1A Q16665 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL1779249 0.77 NPC1 (0.46) NPC1RAB9AMAPTKDM4EL3MBTL1
SCHEMBL13598047 0.74 EGFR (0.64) EGFRNPC1RAB9AMAPTKDM4E
SCHEMBL14226047 0.68 KMT2A (0.54) EGFRNPC1RAB9AALDH1A1LMNA
SCHEMBL15635468 0.64 ALDH1A1 (0.42) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL31241045 0.64 KCNQ3 (0.53) RAB9AKDM4ELMNAMEN1KMT2A
SCHEMBL2275255 0.63 MEN1 (0.43) RAB9AMAPTKDM4EPOLBL3MBTL1
SCHEMBL9204204 0.62 CA12 (0.52) NPC1RAB9AMAPTKDM4EPOLB
SCHEMBL27468291 0.60 MEN1 (0.51) NPC1RAB9AMAPTTP53MEN1
SCHEMBL7934008 0.59 TSHR (0.39) NPC1RAB9AMAPTPOLBL3MBTL1
SCHEMBL6169811 0.59 CCNK (0.46) EGFRNPC1RAB9AMAPTKDM4E

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
WO-2007007905-A2 CARBOXAMIDE COMPOUND AND USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-01-18 WO disclosed