SCHEMBL29060048

SCHEMBL29060048

CCCCCCCCCCCCOC(=O)CC(N)C(=O)OCCCCCCCCCCCC.CCS(=O)(=O)O

nearest known ligand 0.51

Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.50
▸ HTR2C P28335 1/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ RAD52 P43351 1/20 0.44
▸ FAAH O00519 1/20 0.43
▸ DGKA P23743 1/20 0.42
▸ NOD1 Q9Y239 2/20 0.41
▸ PRSS1 P07477 1/20 0.41
▸ PRSS2 P07478 1/20 0.41
▸ PRSS3 P35030 1/20 0.41
▸ EPHX1 P07099 1/20 0.40
▸ P2RY10 O00398 4/20 0.40
▸ GPR34 Q9UPC5 2/20 0.40
▸ TSHR P16473 1/20 0.39

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
SCHEMBL2981700 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL9442151 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2283336 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL17231345 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL9718427 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2283331 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2283589 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2279553 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2983597 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1
SCHEMBL2283596 0.92 NAAA (0.58) NAAAHTR2CNPSR1MAPTMAPK1

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-116670113-A Compositions containing dialkylamino acid ester salts 斯蒂潘公司 2023-08-29 — — CN claimed
CN-116670113-A Compositions containing dialkylamino acid ester salts 斯蒂潘公司 2023-08-29 — — CN disclosed
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