SCHEMBL5990089

SCHEMBL5990089

CC(C)c1ccc(O)c(C(=O)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 2/20 0.55
▸ HSP90AB1 P08238 2/20 0.55
▸ BCL2 P10415 1/20 0.54
▸ MCL1 Q07820 1/20 0.54
▸ LMNA P02545 5/20 0.50
▸ MAPT P10636 5/20 0.50
▸ HPGD P15428 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ RECQL P46063 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ GABRA1 P14867 1/20 0.50
▸ GABRB1 P18505 1/20 0.50
▸ PTGS1 P23219 3/20 0.49
▸ PTGS2 P35354 3/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ KEAP1 Q14145 1/20 0.49

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
SCHEMBL8130100 0.89 HSP90AA1 (0.51) HSP90AA1HSP90AB1BCL2MCL1MAPT
SCHEMBL28424851 0.85 BCL2 (0.59) BCL2MCL1LMNAMAPTHPGD
SCHEMBL10138484 0.84 ALDH1A1 (0.50) HSP90AA1HSP90AB1BCL2MCL1LMNA
SCHEMBL1649282 0.80 ALDH1A1 (0.62) HSP90AA1HSP90AB1MCL1HPGDKDM4E
SCHEMBL28355059 0.80 BCL2 (0.58) BCL2MCL1LMNAMAPTHPGD
SCHEMBL5992775 0.80 MAPT (0.55) BCL2MCL1LMNAMAPTHPGD
SCHEMBL11858542 0.79 LIG1 (0.65) HSP90AA1HSP90AB1BCL2MCL1LMNA
SCHEMBL29823118 0.77 CSNK2A1 (0.63) LMNAMAPTHPGDKDM4ECYP3A4
SCHEMBL147250 0.77 CSNK2A1 (0.63) LMNAMAPTHPGDKDM4ECYP3A4
SCHEMBL30718463 0.77 HSP90AA1 (0.47) HSP90AA1HSP90AB1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 — — US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 — — EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 — — WO disclosed
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