SCHEMBL9628988

SCHEMBL9628988

COc1cccc(C(=O)c2ccc(C(C)(C)C)cc2)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ MAPK1 P28482 4/20 0.54
▸ HSD17B10 Q99714 4/20 0.54
▸ ALOX15 P16050 4/20 0.54
▸ LMNA P02545 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ HPGD P15428 2/20 0.54
▸ RECQL P46063 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.52
▸ SRD5A2 P31213 1/20 0.46
▸ KLK1 P06870 1/20 0.46
▸ KLK5 Q9Y337 1/20 0.46
▸ SIRT1 Q96EB6 1/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ POLB P06746 1/20 0.45
▸ TSHR P16473 1/20 0.45

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
SCHEMBL9339212 0.83 NPC1 (0.59) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL1696776 0.83 MAPT (0.76) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL23463695 0.82 MAPT (0.56) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL9721247 0.81 SIRT1 (0.54) MAPTKDM4EHSD17B10ALOX15ALDH1A1
SCHEMBL480276 0.81 KDM4E (0.59) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL22588880 0.79 KDM4E (0.57) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL2066210 0.79 KDM4E (0.57) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL8746603 0.76 ALOX15 (0.56) MAPTKDM4EMAPK1HSD17B10ALOX15
SCHEMBL9395071 0.75 MAPT (0.54) MAPTMAPK1HSD17B10ALOX15LMNA
SCHEMBL9628983 0.73 ELANE (0.49) MAPTLMNATDP1NPSR1SRD5A2

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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