SCHEMBL4662243

SCHEMBL4662243

C/C(=C\CCNOP(=O)(O)O)CO

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 11/20 0.53
FNTA P49354 6/20 0.36
FNTB P49356 4/20 0.36
PGGT1B P53609 2/20 0.36
GGPS1 O95749 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
SCHEMBL28686248 0.71 LPAR3 (0.42) FNTAFNTB
SCHEMBL8157247 0.69
SCHEMBL12640196 0.69 BTN3A1 (1.00) BTN3A1FNTAFNTBPGGT1B
SCHEMBL13101858 0.69 BTN3A1 (1.00) BTN3A1FNTAFNTBPGGT1B
SCHEMBL28760635 0.69 BTN3A1 (0.58) BTN3A1FNTAFNTBPGGT1BGGPS1
SCHEMBL27661431 0.69 BTN3A1 (0.58) BTN3A1FNTAFNTBPGGT1BGGPS1
SCHEMBL24835115 0.69 BTN3A1 (1.00) BTN3A1FNTAFNTB
SCHEMBL12640204 0.69 BTN3A1 (1.00) BTN3A1FNTAFNTB
SCHEMBL10002547 0.69 BTN3A1 (1.00) BTN3A1FNTAFNTB
SCHEMBL21064947 0.68

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
EP-1761278-B1 ADJUVANT COMPOSITION AND METHODS FOR ITS USE INNATE PHARMA (FR) 2008-12-31 EP claimed