SCHEMBL29094947

SCHEMBL29094947

COC(=O)C1=CC=CC(C(=O)O)(c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC9 Q9UKV0 1/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 2/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL6128103 0.83 AKR1C1 (0.37) TSHRKMT2AHDAC9HTTLMNA
SCHEMBL28808541 0.77 HDAC9 (0.33) HDAC9AKR1C1
SCHEMBL28185148 0.75 OPRM1 (0.34) KMT2AMEN1HDAC9MAPTRAB9A
SCHEMBL7156236 0.73 HSD11B1 (0.38) SLC6A2SLC6A4
SCHEMBL8125370 0.73 CHRM3 (0.33) TSHRSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL1434701 0.72 HDAC9 (0.34) TSHRHDAC9MAPTL3MBTL1AKR1C1
SCHEMBL28466983 0.70 CHRM3 (0.35) TSHRCHRM2CHRM4CHRM5CHRM1
SCHEMBL67176 0.69 CHRM3 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28881873 0.69 CHRM3 (0.34) TSHRCHRM2CHRM4CHRM5CHRM1
SCHEMBL8124602 0.69 SLC6A3 (0.35) SLC6A4SLC6A3

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
CN-114716592-B Propylene polymerization catalyst component, catalyst and preparation method thereof 中国石油天然气股份有限公司 2023-10-31 CN disclosed