SCHEMBL9709967

SCHEMBL9709967

O=C(O)/C(Cl)=C\c1cccs1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.52
KMT2A Q03164 4/20 0.47
MAPT P10636 4/20 0.44
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
GCK P35557 1/20 0.42
PLA2G7 Q13093 1/20 0.41
GLA P06280 1/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
DAO P14920 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL9709969 1.00 HCAR2 (0.52) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL9709963 1.00 HCAR2 (0.52) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL9709952 0.86 HCAR2 (0.48) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL9709956 0.86 HCAR2 (0.48) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL9709946 0.86 HCAR2 (0.48) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL11539420 0.80 HCAR2 (0.55) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL8303646 0.80 HCAR2 (0.55) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL8303644 0.80 HCAR2 (0.55) HCAR2KMT2AMAPTLMNANPSR1
SCHEMBL11277206 0.77
SCHEMBL1930557 0.77 AKR1C3 (0.52) HCAR2KMT2AMAPTLMNANPSR1

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-1992020689-A1 ANTIBACTERIAL PENEM DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 1992-11-26 WO disclosed