SCHEMBL5834545

SCHEMBL5834545

C=CC(=O)OC(=O)c1ccccc1OC(=O)C=C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
HSD17B10 Q99714 6/20 0.50
HPGD P15428 4/20 0.50
MAPT P10636 2/20 0.50
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TYMS P04818 1/20 0.40
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
LIG1 P18858 1/20 0.40
CYP3A4 P08684 1/20 0.40
ESR1 P03372 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
HMGB1 P09429 1/20 0.40
GGT1 P19440 1/20 0.40

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
SCHEMBL29531388 0.85 CYP3A4 (0.52) KDM4EHSD17B10HPGDMAPTTHRB
SCHEMBL5069944 0.85 CYP3A4 (0.52) KDM4EHSD17B10HPGDMAPTTHRB
Methyl Salicylate Acrylic Ester SCHEMBL1054590 0.85 SLC6A3 (0.61) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL27385335 0.85 HPGD (0.49) HSD17B10HPGDMAPTALDH1A1TSHR
SCHEMBL8855153 0.83 HSD17B10 (0.56) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL752535 0.82 KDM4E (0.73) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL29378503 0.82 KDM4E (0.73) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL3841280 0.81 THRB (0.56) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL29413361 0.81 THRB (0.56) KDM4EHSD17B10HPGDMAPTTHRA
SCHEMBL1055222 0.81 TSHR (0.59) KDM4EHSD17B10HPGDMAPTTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6368615-B1 POLYMER OF UNSATURATED ESTER OF SALICYLIC ACID GUTTAG ALVIN (US) 2002-04-09 US claimed
CN-110302062-B Dental adhesive glass ion water-gate composition with good removability 株式会社松风 2024-06-07 CN disclosed
US-7015247-B2 Ibuprofen-aspirin, hydroxymethylacylfulvene analogs and L-sugar illudin analogs GUTTAG ALVIN 2006-03-21 US disclosed
US-20030008833-A1 Ibuprofen-aspirin, hydroxymethylacylfulvene analogs and L-sugar illudin analogs GUTTAG ALVIN (US) 2003-01-09 US disclosed
US-6436916-B1 PHENOLIC ESTERS OF IBUPROFEN WITH SALICYLIC ACID OR ITS NONTOXIC SALTS USED AS ANTITUMOR AGENT GUTTAG ALVIN (US) 2002-08-20 US disclosed
US-20020065254-A1 Ibuprofen-aspirin and hydroxymethylacylfulvene analogs GUTTAG ALVIN (US) 2002-05-30 US disclosed
US-6368615-B1 POLYMER OF UNSATURATED ESTER OF SALICYLIC ACID GUTTAG ALVIN (US) 2002-04-09 US disclosed
US-6037338-A AND REDUCING RISK OF HEART ATTACKS GUTTAG ALVIN (US) 2000-03-14 US disclosed
US-5910511-A ALTERNATIVE TO ASPIRIN WHICH HAS LESSER UNDESIRABLE SIDE EFFECTS GUTTAG ALVIN (US) 1999-06-08 US disclosed
US-5760261-A ANTINFLAMMATORY AGENTS, ANTIPYRETICS, ANALGESICS; SIDE EFFECTREDUCTION GUTTAG ALVIN (US) 1998-06-02 US disclosed
US-5648084-A Multiple dosage medicine drop bottle GUTTAG ALVIN (US) 1997-07-15 US 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 (2 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-20020065254-A1 Ibuprofen-aspirin and hydroxymethylacylfulvene analogs PTGES3, HPGDS, PTGES KDM4E 653/4885HSD17B10 623/4885HPGD 25/4885
US-20030008833-A1 Ibuprofen-aspirin, hydroxymethylacylfulvene analogs and L-sugar illudin analogs GALE, TPT1, HPSE KDM4E 1066/4885HSD17B10 1828/4885HPGD 684/4885

“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.