SCHEMBL18867719

SCHEMBL18867719

Cc1cc(CCC(O)c2cccc(O)c2)cc(Cl)c1C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITGAL P20701 1/20 0.59
▸ S1PR1 P21453 4/20 0.44
▸ DRD3 P35462 2/20 0.44
▸ SLC6A3 Q01959 2/20 0.44
▸ S1PR4 O95977 1/20 0.44
▸ TSPO P30536 1/20 0.44
▸ HTR2B P41595 1/20 0.44
▸ PYGL P06737 1/20 0.39
▸ KYNU Q16719 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ ITGB1 P05556 3/20 0.38
▸ ITGA4 P13612 3/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ ITGA2 P17301 1/20 0.38
▸ ITGB7 P26010 1/20 0.38
▸ HIF1A Q16665 4/20 0.37
▸ ADRB2 P07550 1/20 0.37
▸ ADRB1 P08588 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ ADRA2A P08913 1/20 0.37

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
SCHEMBL13666886 0.94 ITGAL (0.65) ITGALS1PR1DRD3SLC6A3S1PR4
SCHEMBL13668215 0.86 ITGAL (0.51) ITGALS1PR1DRD3SLC6A3PYGL
SCHEMBL14613755 0.80 ITGAL (0.45) ITGALS1PR1DRD3SLC6A3S1PR4
SCHEMBL18885625 0.80 ITGAL (0.60) ITGALS1PR1PYGLKYNUITGB1
SCHEMBL14613923 0.79 ITGAL (0.67) ITGALPYGLKYNUITGB1ITGA4
SCHEMBL18867651 0.78 ITGAL (0.47) ITGALDRD3SLC6A3KYNUEPHX2
SCHEMBL16307471 0.77 ITGAL (0.57) ITGALS1PR1ITGB1ITGA4ITGA2
SCHEMBL18881151 0.76 ITGAL (0.56) ITGALS1PR1PYGLITGB1ITGA4
SCHEMBL19157703 0.76 ITGAL (0.56) ITGALITGB1ITGA4ITGA2ITGB7
SCHEMBL18362373 0.76 ITGAL (0.55) ITGALDRD3SLC6A3HTR2BKYNU

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-3167886-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF MACULAR EDEMA SARcode Bioscience Inc. (US) 2017-05-17 — — EP disclosed
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