SCHEMBL2149054

SCHEMBL2149054

CCCCOC(=O)NC(Cc1ccc(OC)cc1O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TSHR P16473 1/20 0.43
ITGB3 P05106 9/20 0.41
ITGA2B P08514 9/20 0.41
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41
ITGAL P20701 1/20 0.41
ITGB1 P05556 1/20 0.41
ITGA4 P13612 1/20 0.41
CA2 P00918 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL1721256 0.84 ITGB3 (0.41) TSHRITGB3ITGA2BITGB1ITGA4
SCHEMBL8485515 0.82 FPR2 (0.54) ITGB3ITGA2BITGB1ITGA4CA2
SCHEMBL2320402 0.82 FPR2 (0.54) ITGB3ITGA2BITGB1ITGA4CA2
SCHEMBL5502788 0.82 FPR2 (0.52) POLBITGB3ITGA2BALDH1A1ALOX15
SCHEMBL1310039 0.81 PTPN1 (0.53) POLBITGB3ITGA2BITGA4
SCHEMBL6251044 0.81 ITGB3 (0.41) TSHRITGB3ITGA2BITGB1ITGA4
SCHEMBL5199846 0.80 ALDH1A1 (0.41) TSHRITGB3ITGA2BALDH1A1ALOX15
SCHEMBL5088784 0.79 ALDH1A1 (0.52) TSHRITGB3ITGA2BITGA4ALDH1A1
SCHEMBL10477347 0.79 ITGB3 (0.39) TSHRITGB3ITGA2BITGB1ITGA4
SCHEMBL10477348 0.79 ITGB3 (0.39) TSHRITGB3ITGA2BITGB1ITGA4

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
EP-2342194-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-07-13 EP disclosed
WO-2010052253-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-05-14 WO disclosed