SCHEMBL22084694

SCHEMBL22084694

CCCCC1(C)OB(c2ccc(Cn3cc(F)c(=O)[nH]c3=O)cc2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 5/20 0.40
▸ LIPG Q9Y5X9 5/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ LMNA P02545 1/20 0.34

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
SCHEMBL22084414 0.88 LPL (0.43) LPLLIPGHPGDLMNA
SCHEMBL22084416 0.79 HPGD (0.38) HPGDLMNA
SCHEMBL22084393 0.76 HPGD (0.40) HPGDLMNA
SCHEMBL22084413 0.76 HPGD (0.38) HPGDLMNA
SCHEMBL22084415 0.74 HPGD (0.42) SMN1; SMN2HPGDLMNA
SCHEMBL22084380 0.74 HPGD (0.41) HPGD
SCHEMBL22084696 0.72 HPGD (0.45) HPGD
SCHEMBL22084420 0.72 HPGD (0.39) HPGDLMNA
SCHEMBL22084391 0.72 HPGD (0.39) HPGDLMNA
SCHEMBL21231761 0.71 LIPG (0.56) LPLLIPG

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-2020117938-A1 PRODRUGS OF ANTI-CANCER AND ANTI-AUTOIMMUNE DISEASES THERAPEUTIC AGENTS, AND METHODS OF MAKING AND USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2020-06-11 — — WO disclosed
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