SCHEMBL8710468

SCHEMBL8710468

CCCc1c(C(C#N)C(=O)O)oc2ccc(Cl)cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.43
KCNH2 Q12809 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAOB P27338 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MCL1 Q07820 2/20 0.38
NQO1 P15559 1/20 0.38
ADORA3 P0DMS8 2/20 0.37
TSHR P16473 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
SIRT1 Q96EB6 1/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 1/20 0.35
AURKA O14965 1/20 0.35
JAK2 O60674 1/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL5675844 0.74 TTR (0.46) TTRMEN1KMT2ANPC1RAB9A
SCHEMBL8709921 0.72 ADORA3 (0.46) TTRMEN1KMT2ANPC1RAB9A
SCHEMBL8715528 0.70 TTR (0.42) TTRMEN1KMT2ANPC1RAB9A
SCHEMBL8710058 0.69 AKR1B1 (0.46) TTRMEN1KMT2ANPC1RAB9A
SCHEMBL11324534 0.64 MCL1 (0.57) TTRKCNH2MEN1KMT2ANPC1
SCHEMBL10515077 0.64 MAPT (0.50) KCNH2MEN1KMT2AKDM4ECSNK2A1
SCHEMBL4092241 0.63 TTR (0.71) TTRMEN1KMT2ANPC1RAB9A
SCHEMBL5677180 0.62 APP (0.36) TTRNPC1RAB9AALDH1A1NQO1
SCHEMBL5680363 0.62 KMT2A (0.42) KMT2AKDM4EMAPK1PIM1CSNK2A1
SCHEMBL21858350 0.62 MCL1 (0.80) TTRKCNH2MEN1KMT2ANPC1

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-1998027080-A1 CHROMONES USEFUL AS FUNGICIDES AGREVO UK LIMITED (GB) 1998-06-25 WO disclosed