SCHEMBL5111334

SCHEMBL5111334

Cc1cc(C(C)(C)C)c(O)c(C)c1COc1nc(OCc2c(C)cc(C(C)(C)C)c(O)c2C)nc(OCc2c(C)cc(C(C)(C)C)c(O)c2C)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 5/20 0.49
▸ PTGS2 P35354 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ CYP3A4 P08684 2/20 0.49
▸ HTR1A P08908 2/20 0.49
▸ ADRA2A P08913 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ CHRM4 P08173 1/20 0.49
▸ CHRM5 P08912 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ADRA2B P18089 1/20 0.49
▸ ADRA2C P18825 1/20 0.49
▸ ADRA1D P25100 1/20 0.49
▸ HTR1D P28221 1/20 0.49
▸ HTR1B P28222 1/20 0.49
▸ HTR2A P28223 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
SCHEMBL10818994 0.83 CYP2C19 (0.50) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL28301369 0.82 CYP2C19 (0.49) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10972676 0.81 CYP2C19 (0.48) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10819121 0.79 CYP2C19 (0.47) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10816941 0.79 CYP2C19 (0.49) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL11030135 0.78 CYP2C19 (0.46) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10816932 0.78 CYP2C19 (0.46) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10814873 0.78 CYP2C19 (0.61) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10482096 0.78 CYP2C19 (0.58) CYP2C19PTGS2LMNACYP3A4HTR1A
SCHEMBL10000643 0.76 CYP2C19 (0.52) CYP2C19PTGS2LMNACYP3A4HTR1A

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
US-7351767-B2 Composition for monovinylrenic-based shrink label films CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2008-04-01 — — US claimed
US-20060089457-A1 Composition for monovinylrenic-based shrink label films CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-04-27 — — US claimed
US-7351767-B2 Composition for monovinylrenic-based shrink label films CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2008-04-01 — — US disclosed
WO-2006047665-A1 COMPOSITION COMPRISING A MONOVINYLARENE-CONJUGATED DIENE COPOLYMER AND AN ACRYLATE TERPOLYMER AND SHRINK FILMS MADE THEREOF CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-05-04 — — WO disclosed
US-20060089457-A1 Composition for monovinylrenic-based shrink label films CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-04-27 — — US disclosed
US-5422389-A Preparing stabilizer by mixing hindered phenolic compound in organic phosphite without other organic solvent PHILLIPS PETROLEUM COMPANY (US) 1995-06-06 — — US disclosed
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