SCHEMBL8948893

SCHEMBL8948893

CO/C(=C/C(=O)O)c1ccccc1C

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KCNK3 O14649 1/20 0.40
POLB P06746 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40

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
SCHEMBL8948899 1.00 HPGD (0.47) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL13183339 0.83 MAPT (0.41) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL8949240 0.83 TSHR (0.50) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL8949246 0.83 TSHR (0.50) HPGDERCC5FEN1NPC1RAB9A
SCHEMBL9222114 0.81 CA12 (0.56) HPGDNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL9222109 0.81 CA12 (0.56) HPGDNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL8948907 0.79 ALDH1A1 (0.39) HPGDKMT2AKDM4ELMNASMN1; SMN2
SCHEMBL8948913 0.79 ALDH1A1 (0.39) HPGDKMT2AKDM4ELMNASMN1; SMN2
SCHEMBL1536368 0.77 TSHR (0.59) HPGDNPC1RAB9AKMT2AKDM4E
SCHEMBL3189100 0.77 TSHR (0.59) HPGDNPC1RAB9AKMT2AKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5573999-A FUNGICIDES AND INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-11-12 US disclosed
US-5538940-A FUNGICIDE, MITICIDE, INSECTICIDE BASF AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed