SCHEMBL20195640

SCHEMBL20195640

CCOc1cccc(C(=O)Cl)c1COc1cccc(C)n1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.42
GABRA5 P31644 2/20 0.41
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK8 P45983 1/20 0.39
GRM5 P41594 1/20 0.38
HCRTR1 O43613 4/20 0.37
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HCRTR2 O43614 2/20 0.36
GBA1 P04062 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL20195626 0.89 GABRA5 (0.42) GABRA5KDM4EL3MBTL1GRM5NPC1
SCHEMBL20195590 0.89 GABRA5 (0.44) TP53GABRA5KDM4EL3MBTL1MAPK8
SCHEMBL20195624 0.84 GABRA5 (0.43) GABRA5L3MBTL1NPC1RAB9ALMNA
SCHEMBL20195641 0.79 P2RX7 (0.43) KDM4EL3MBTL1HCRTR1MAPTMEN1
SCHEMBL18504683 0.79 KDM4E (0.38) KDM4EL3MBTL1HCRTR1MAPTRAB9A
SCHEMBL20195502 0.79 GABRA5 (0.40) GABRA5HCRTR1HCRTR2
SCHEMBL22564252 0.78 KDM4E (0.37) KDM4EL3MBTL1HCRTR1MAPTRAB9A
SCHEMBL20195552 0.77 ALDH1A1 (0.43) L3MBTL1NPC1MAPTRAB9ALMNA
SCHEMBL20195466 0.74 P2RX7 (0.37) TP53GABRA5KDM4EMAPK8GRM5
SCHEMBL20195622 0.73 GABRA5 (0.46) TP53GABRA5NPC1MAPTRAB9A

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
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed