SCHEMBL29136154

SCHEMBL29136154

O=C(OCl)C(O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.58
MAPK1 P28482 1/20 0.58
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
HPGD P15428 1/20 0.47
KMT2A Q03164 2/20 0.45
CYP2D6 P10635 3/20 0.45
CYP2C9 P11712 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CHRM3 P20309 2/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
SRC P12931 2/20 0.43
NR1I2 O75469 1/20 0.42
ABCB11 O95342 1/20 0.42

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
SCHEMBL8528299 1.00 LMNA (0.58) LMNAMAPK1CES2CES1HPGD
Hydrochloric Acid SCHEMBL9617551 0.98 LMNA (0.56) LMNAMAPK1CES2CES1HPGD
SCHEMBL28180749 0.98 LMNA (0.56) LMNAMAPK1CES2CES1HPGD
SCHEMBL352390 0.82 LMNA (0.62) LMNAMAPK1CES2CES1HPGD
SCHEMBL1951103 0.82 LMNA (0.62) LMNAMAPK1CES2CES1HPGD
SCHEMBL19489392 0.80 LMNA (0.60) LMNAMAPK1CES2CES1HPGD
SCHEMBL529525 0.80 L3MBTL1 (0.56) LMNAMAPK1CES2CES1KMT2A
SCHEMBL10787054 0.78 LMNA (0.58) LMNAMAPK1CES2CES1HPGD
SCHEMBL19107009 0.78 LMNA (0.58) LMNAMAPK1CES2CES1HPGD
SCHEMBL12381451 0.78 LMNA (0.58) LMNAMAPK1CES2CES1HPGD

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-117338631-A Skin care lotion prepared based on bidirectional indissolvable substance microemulsifying technology and preparation method thereof 贵州九立德生物制药有限公司 2024-01-05 CN claimed
CN-117338631-A Skin care lotion prepared based on bidirectional indissolvable substance microemulsifying technology and preparation method thereof 贵州九立德生物制药有限公司 2024-01-05 CN disclosed
CN-110172021-B Separation and extraction method of (R) -o-chloromandelic acid 武汉武药制药有限公司 2022-04-22 CN disclosed