SCHEMBL10825191

SCHEMBL10825191

CCCCCCCCCCCCCCCC(CC(=O)OC(C)(C)C)OC(=O)CCCCCNC(=O)CCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPEPLD Q6IQ20 1/20 0.46
MAPK1 P28482 3/20 0.45
MAPT P10636 2/20 0.45
CASP2 P42575 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
FAAH O00519 3/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
NAAA Q02083 1/20 0.43
DNM1 Q05193 1/20 0.42
EPHX2 P34913 3/20 0.41
TLR4 O00206 1/20 0.41
CYP1A2 P05177 2/20 0.41
MEN1 O00255 1/20 0.41
GMNN O75496 1/20 0.41
HSP90AA1 P07900 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NR1H4 Q96RI1 1/20 0.41

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
SCHEMBL10800244 0.89 MAPK1 (0.55) MAPK1MAPTLMNAALDH1A1CYP1A2
SCHEMBL11105366 0.89 MAPK1 (0.55) MAPK1MAPTLMNAALDH1A1CYP1A2
SCHEMBL11100702 0.89 MAPK1 (0.55) MAPK1MAPTLMNAALDH1A1CYP1A2
SCHEMBL11100643 0.88 MAPK1 (0.53) MAPK1MAPTLMNAALDH1A1CYP1A2
SCHEMBL10825383 0.87 FAAH (0.46) NAPEPLDMAPK1MAPTFAAHLMNA
SCHEMBL10825230 0.85 MAPK1 (0.56) NAPEPLDMAPK1MAPTCASP2L3MBTL1
SCHEMBL24894495 0.85 CASP2 (0.57) CASP2L3MBTL1FAAHNAAADNM1
SCHEMBL17751908 0.84 CASP2 (0.59) MAPTCASP2L3MBTL1FAAHALDH1A1
SCHEMBL540944 0.84 CASP2 (0.59) MAPTCASP2L3MBTL1FAAHALDH1A1
SCHEMBL20262184 0.83 TDP1 (0.51) MAPK1MAPTLMNAALDH1A1EPHX2

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
US-4629736-A HIGH FIBRINOLYTIC ACTION; WATER SOLUBILITY; ANTICOAGULANTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-12-16 US disclosed
EP-0136879-A2 Fatty acid derivatives and processes of producing them YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1985-04-10 EP disclosed