SCHEMBL6269540

SCHEMBL6269540

CCCCCCCCCCCCO[C@H]1O[C@H]([C@H](C)NC(=O)CCC(=O)O)[C@@H]2OC(C)(C)O[C@H]12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 2/20 0.34
▸ PLA2G2C Q5R387 2/20 0.34
▸ FAAH O00519 4/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ TLR4 O00206 1/20 0.32
▸ PPARG P37231 2/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ SELE P16581 2/20 0.30

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
SCHEMBL6265775 0.89 KMT2A (0.34) FAAHMEN1KMT2AMAPK1
SCHEMBL6271515 0.87 KMT2A (0.33) PLA2G10PLA2G2CFAAHMEN1KMT2A
SCHEMBL6268661 0.85 EPHX1 (0.41) MAPK1
SCHEMBL6271183 0.85 MAPK1 (0.35) MEN1KMT2AMAPK1
SCHEMBL6272082 0.84 NOD1 (0.33) MEN1KMT2AMAPK1
SCHEMBL6265820 0.80 TDP1 (0.39) FAAHMEN1KMT2A
SCHEMBL6266444 0.80 MEN1 (0.32) MEN1KMT2AMAPK1
SCHEMBL6267413 0.80 LMNA (0.30) —
SCHEMBL6271654 0.78 S1PR1 (0.38) MEN1KMT2A
SCHEMBL6269541 0.78 HTR2C (0.38) FAAHMEN1KMT2AMAPK1

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
WO-2005092907-A2 MONOSACCHARIDE DERIVATIVES AS ANTI-CANCER AND ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2005-10-06 — — WO disclosed
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