SCHEMBL9628983

SCHEMBL9628983

CC(C)(C)c1ccc(C(=O)c2ccccc2OCO)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.49
▸ SRD5A2 P31213 1/20 0.46
▸ RAB9A P51151 5/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ ABCB1 P08183 4/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ SIRT1 Q96EB6 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
SCHEMBL30149165 0.82 DRD2 (0.57) ELANERAB9AKMT2AMAPTABCB1
SCHEMBL769670 0.82 DRD2 (0.57) ELANERAB9AKMT2AMAPTABCB1
SCHEMBL29945615 0.81 DRD2 (0.56) ELANERAB9AKMT2AMAPTABCB1
SCHEMBL1161009 0.81 DRD2 (0.56) ELANERAB9AKMT2AMAPTABCB1
SCHEMBL9395071 0.81 MAPT (0.54) ELANESRD5A2KMT2ANPSR1MAPT
SCHEMBL489857 0.79 ALDH1A1 (0.48) ELANEKMT2AMAPTMEN1ABCB1
Sulfuric Acid SCHEMBL28055088 0.77 DRD2 (0.52) ELANERAB9AKMT2AMAPTABCB1
SCHEMBL10445015 0.74 TP53 (0.58) SRD5A2RAB9AKMT2AMAPTMEN1
SCHEMBL11176158 0.74 TDP1 (0.66) SRD5A2RAB9AKMT2AMEN1NPC1
SCHEMBL29550462 0.74 TDP1 (0.66) SRD5A2RAB9AKMT2AMEN1NPC1

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-0478747-A1 SURFACE MODIFIED, U.V. STABILIZED, POLYVINYL CHLORIDE ARTICLE ATOCHEM NORTH AMERICA, INC. (US) 1992-04-08 — — EP disclosed
WO-1991016143-A1 SURFACE MODIFIED, U.V. STABILIZED, POLYVINYL CHLORIDE ARTICLE ATOCHEM NORTH AMERICA, INC. (US) 1991-10-31 — — WO disclosed
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