SCHEMBL30336367

SCHEMBL30336367

Cc1cc(C)c(O)c(C(=O)c2ccc(O)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
HPGD P15428 5/20 0.48
LMNA P02545 4/20 0.48
MAPT P10636 4/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
PKM P14618 1/20 0.48
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP3A4 P08684 1/20 0.46
RECQL P46063 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LIG1 P18858 1/20 0.46
NPC1 O15118 3/20 0.44
KMT2A Q03164 3/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL30204449 1.00 HTT (0.53) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL10357783 0.86 PTGS1 (0.45) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL10175303 0.84 HTT (0.59) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL10684266 0.83 HMGB1 (0.43) LMNAMAPTESR1ALDH1A1KDM4E
SCHEMBL28413744 0.82 ALDH1A1 (0.48) HPGDLMNAMAPTALDH1A1KDM4E
SCHEMBL29670017 0.82 ALDH1A1 (0.48) HPGDLMNAMAPTALDH1A1KDM4E
SCHEMBL9544691 0.81 HTT (0.56) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL11016647 0.78 HTT (0.56) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL9012657 0.77 HTT (0.71) HTTSMN1; SMN2HPGDLMNAMAPT
SCHEMBL6842046 0.77 BCL2 (0.54) HTTSMN1; SMN2HPGDLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111892486-B Hydroxyl-substituted benzophenone compound and preparation method and application thereof 莆田学院 2023-04-18 CN claimed
CN-111892486-B Hydroxyl-substituted benzophenone compound and preparation method and application thereof 莆田学院 2023-04-18 CN disclosed
CN-111892486-B Hydroxyl-substituted benzophenone compound and preparation method and application thereof 莆田学院 2023-04-18 CN disclosed