SCHEMBL10728817

SCHEMBL10728817

Cc1ccc(OCC(=O)O)c(C)c1[O]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ FHIT P49789 1/20 0.47
▸ PTGDR2 Q9Y5Y4 5/20 0.46
▸ MCL1 Q07820 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.45
▸ TSHR P16473 2/20 0.44
▸ PPARG P37231 1/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ PKM P14618 1/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ABCC3 O15438 1/20 0.42
▸ PLIN1 O60240 1/20 0.42

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
SCHEMBL10459386 0.86 L3MBTL1 (0.47) L3MBTL1POLBSMN1; SMN2GLAFHIT
SCHEMBL7288512 0.85 L3MBTL1 (0.50) L3MBTL1POLBSMN1; SMN2GLAFHIT
SCHEMBL14060872 0.82 L3MBTL1 (0.47) L3MBTL1POLBSMN1; SMN2GLAFHIT
SCHEMBL10733976 0.80 L3MBTL1 (0.49) L3MBTL1POLBSMN1; SMN2GLAFHIT
SCHEMBL5379717 0.77 L3MBTL1 (0.63) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL2059383 0.76 POLB (0.58) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL5699380 0.75 PKM (0.54) L3MBTL1POLBSMN1; SMN2GLAFHIT
SCHEMBL11603936 0.74 TDP1 (0.56) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL3064143 0.73 TSHR (0.70) POLBSMN1; SMN2PTGDR2TDP1TSHR
SCHEMBL2113005 0.73 PTGDR2 (0.64) POLBSMN1; SMN2PTGDR2TDP1TSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0072211-B1 RADIATION STERILIZABLE ABSORBABLE POLYMERIC MATERIALS AND METHODS FOR MANUFACTURING THE SAME ETHICON, INC. (US) 1987-10-28 — — EP disclosed
US-4689424-A POLYESTERS ETHICON, INC. (US) 1987-08-25 — — US disclosed
US-4649921-A ABSORBABLE SUTURES FOR SURGERY ETHICON, INC. (US) 1987-03-17 — — US disclosed
US-4546152-A Poly(p-dioxanone) polymers having improved radiation resistance ETHICON, INC. (US) 1985-10-08 — — US disclosed
US-4435590-A Radiation sterilizable absorbable polymeric materials and methods for manufacturing the same ETHICON, INC. (US) 1984-03-06 — — US disclosed
EP-0072211-A2 Radiation sterilizable absorbable polymeric materials and methods for manufacturing the same ETHICON, INC. (US) 1983-02-16 — — EP disclosed
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