SCHEMBL30940475

SCHEMBL30940475

O=C(Cc1ccccc1)OO.[Na]

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.61
ALDH1A1 P00352 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
PAM P19021 1/20 0.59
TSHR P16473 1/20 0.57
CES1 P23141 2/20 0.56
CES2 O00748 1/20 0.56
AKR1B1 P15121 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.52
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CYP19A1 P11511 1/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47

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
SCHEMBL247574 0.98 MAPK1 (0.63) MAPK1ALDH1A1L3MBTL1PAMTSHR
Potassium SCHEMBL30940428 0.95 MAPK1 (0.61) MAPK1ALDH1A1L3MBTL1PAMTSHR
Lithium SCHEMBL30940462 0.95 MAPK1 (0.61) MAPK1ALDH1A1L3MBTL1PAMTSHR
SCHEMBL28331590 0.95 MAPK1 (0.61) MAPK1ALDH1A1L3MBTL1PAMTSHR
SCHEMBL9613510 0.85 LMNA (0.64) MAPK1ALDH1A1L3MBTL1TSHRSMN1; SMN2
Edetic Acid SCHEMBL15152984 0.83 PAM (0.51) MAPK1ALDH1A1L3MBTL1PAMTSHR
Benzene SCHEMBL9407299 0.81 ALDH1A1 (0.65) MAPK1ALDH1A1L3MBTL1PAMTSHR
SCHEMBL248113 0.81 ALDH1A1 (0.65) MAPK1ALDH1A1L3MBTL1PAMTSHR
SCHEMBL664857 0.81 ALDH1A1 (0.65) MAPK1ALDH1A1L3MBTL1PAMTSHR
SCHEMBL10573912 0.80 MAPK1 (0.61) MAPK1ALDH1A1L3MBTL1PAMTSHR

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-118367119-A Organic matter modified carbon-based negative electrode material and manufacturing method thereof 贵州创德新能源科技有限公司 2024-07-19 CN disclosed