SCHEMBL28618006

SCHEMBL28618006

CCOc1ccc(C(=O)c2ccccc2C(=O)O)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HPGD P15428 6/20 0.57
LMNA P02545 5/20 0.56
CYP1A2 P05177 3/20 0.56
PGR P06401 2/20 0.56
SLC6A2 P23975 2/20 0.56
CYP2C19 P33261 2/20 0.56
ALOX15 P16050 2/20 0.56
CYP3A4 P08684 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
AR P10275 1/20 0.56
CHRM1 P11229 1/20 0.56
TBXA2R P21731 1/20 0.56
ADRA1A P35348 1/20 0.56
HIF1A Q16665 1/20 0.56
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 4/20 0.54

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
SCHEMBL6844536 0.90 HPGD (0.69) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL30084733 0.88 NPC1 (0.65) MEN1KMT2AHPGDLMNACYP1A2
SCHEMBL1116290 0.88 NPC1 (0.65) MEN1KMT2AHPGDLMNACYP1A2
SCHEMBL539138 0.86 ALDH1A1 (0.55) MEN1KMT2ASMN1; SMN2HPGDCYP1A2
SCHEMBL29633670 0.85 HPGD (0.76) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL561937 0.85 HPGD (0.76) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL29380442 0.84 HPGD (0.79) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL109604 0.84 HPGD (0.79) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL29357363 0.84 HPGD (0.79) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL4653200 0.83 RAB9A (0.59) MEN1KMT2ASMN1; SMN2HPGDLMNA

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
CN-113330051-B Thermoplastic resin and optical member 帝人株式会社 2023-04-28 CN disclosed
CN-113330051-A Thermoplastic resin and optical member 帝人株式会社 2021-08-31 CN disclosed