SCHEMBL20530359

SCHEMBL20530359

CC(O)C(=O)O[C@H](CC(=O)O)C[N+](C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ CYP1A2 P05177 4/20 0.54
▸ MAPK1 P28482 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ GMNN O75496 3/20 0.53
▸ NPSR1 Q6W5P4 3/20 0.53
▸ TSHR P16473 3/20 0.53
▸ HSP90AA1 P07900 2/20 0.53
▸ BLM P54132 2/20 0.53
▸ NR1H4 Q96RI1 2/20 0.53
▸ CYP2C9 P11712 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ GLA P06280 1/20 0.51
▸ PMP22 Q01453 1/20 0.51
▸ HRH1 P35367 1/20 0.46
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL20530318 1.00 LMNA (0.64) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL25099265 0.87 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL12137159 0.87 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL27925466 0.87 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL12152164 0.87 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL27768779 0.87 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
Bromide SCHEMBL2995962 0.86 LMNA (0.64) LMNASMN1; SMN2CYP1A2MAPK1MAPT
Hydrochloric Acid SCHEMBL8752462 0.86 LMNA (0.69) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL27493791 0.86 LMNA (0.64) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL27777262 0.84 LMNA (0.62) LMNASMN1; SMN2CYP1A2MAPK1MAPT

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
EP-2190402-B2 BIOTIN AND SILICA IN DYE COMPOSITIONS HENKEL AG & CO KGAA (DE) 2018-10-17 — — EP claimed
CN-106604725-A Methods and compositions for treating obesity, preventing weight gain, promoting weight loss, or treating or preventing the development of diabetes NAN全球有限责任公司 2017-04-26 — — CN claimed
CN-106604725-A Methods and compositions for treating obesity, preventing weight gain, promoting weight loss, or treating or preventing the development of diabetes NAN全球有限责任公司 2017-04-26 — — CN disclosed
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