SCHEMBL1405087

SCHEMBL1405087

CC(=O)CCc1cc(C)c(O)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
PTGS1 P23219 2/20 0.48
PTGS2 P35354 2/20 0.48
HMGB1 P09429 1/20 0.44
CXCL12 P48061 1/20 0.44
IAPP P10997 1/20 0.43
S1PR1 P21453 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2B6 P20813 1/20 0.42
MAOA P21397 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
SLC6A2 P23975 1/20 0.42
RAB9A P51151 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
SCHEMBL27986826 0.85 PTGS1 (0.50) PTGS1PTGS2HMGB1CXCL12IAPP
SCHEMBL11704984 0.84 GAA (0.55) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL3580792 0.83 NPSR1 (0.55) PTGS1PTGS2HMGB1CXCL12S1PR1
SCHEMBL5831251 0.83 ALDH1A1 (0.50) ALDH1A1PTGS1PTGS2HMGB1CXCL12
SCHEMBL21712571 0.82 NPC1 (0.41) ALDH1A1PTGS1PTGS2HMGB1CXCL12
SCHEMBL4972642 0.82 PTGS1 (0.47) ALDH1A1PTGS1PTGS2HMGB1CXCL12
SCHEMBL20630754 0.82 ALOX5 (0.47) ALDH1A1PTGS1PTGS2HMGB1CXCL12
SCHEMBL4972635 0.82 PTGS1 (0.47) PTGS1PTGS2HMGB1CXCL12S1PR1
SCHEMBL15262494 0.82 ALDH1A1 (0.48) ALDH1A1IAPPCYP1A2CYP3A4MAOA
SCHEMBL9242013 0.80 POLB (0.49) ALDH1A1PTGS1PTGS2HMGB1CXCL12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479784-B2 Trisphenol derivative HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2025-11-25 US disclosed
US-20230234905-A1 NOVEL TRISPHENOL DERIVATIVE HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2023-07-27 US disclosed
CN-115916734-A Novel triphenol derivatives 本州化学工业株式会社 2023-04-04 CN disclosed
US-8110532-B2 Antioxidant compositions CHEMTURA CORPORATION (US) 2012-02-07 US disclosed
US-8007877-B2 Liquid crystal optical modulation element and optical head device ASAHI GLASS COMPANY, LIMITED (JP) 2011-08-30 US disclosed
EP-2079747-B1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS PFIZER LTD (GB) 2011-03-09 EP disclosed
US-20110037910-A1 LIQUID CRYSTAL OPTICAL MODULATION ELEMENT AND OPTICAL HEAD DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2011-02-17 US disclosed
US-7820250-B2 Liquid crystal optical modulation element and optical head device ASAHI GLASS COMPANY, LIMITED (JP) 2010-10-26 US disclosed
US-20100130396-A1 ANTIOXIDANT COMPOSITIONS CHEMTURA CORPORATION (US) 2010-05-27 US disclosed
EP-2079747-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS Pfizer Limited (GB) 2009-07-22 EP disclosed
US-7494960-B2 Lubricant compositions comprising an antioxidant blend CROMPTON CORPORATION (US) 2009-02-24 US disclosed
US-20080161288-A1 COMPOUNDS PFIZER INC. 2008-07-03 US disclosed
WO-2008044127-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS PFIZER LIMITED (GB) 2008-04-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12479784-B2 Trisphenol derivative TTPA, CCNA2, CDK2AP2 ALDH1A1 1566/4885PTGS1 801/4885PTGS2 145/4885
US-20230234905-A1 NOVEL TRISPHENOL DERIVATIVE TTPA, CDK2AP2, CDKL2 ALDH1A1 2038/4885PTGS1 1135/4885PTGS2 271/4885
US-20080161288-A1 COMPOUNDS ADRB2, ADRB1, ADRA2C ALDH1A1 295/4885PTGS1 1214/4885PTGS2 611/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.