SCHEMBL2337247

SCHEMBL2337247

CC(=O)Oc1ccccc1C(=O)OC(=O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.66
HSD17B10 Q99714 2/20 0.66
LMNA P02545 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP2C9 P11712 1/20 0.66
PTGS2 P35354 5/20 0.64
TSHR P16473 2/20 0.64
ALDH1A1 P00352 1/20 0.64
ESR1 P03372 1/20 0.64
ITGB3 P05106 1/20 0.64
ITGA2B P08514 1/20 0.64
HMGB1 P09429 1/20 0.64
HPGD P15428 1/20 0.64
GGT1 P19440 1/20 0.64
PTGS1 P23219 1/20 0.64
BLM P54132 1/20 0.64
NAPRT Q6XQN6 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
SLC6A3 Q01959 1/20 0.61
MAPK1 P28482 2/20 0.50

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
SCHEMBL2338852 0.95 HSD17B10 (0.63) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL29669847 0.91 HSD17B10 (0.71) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL789771 0.91 HSD17B10 (0.71) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL14674298 0.89 KDM4E (0.56) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL6948356 0.88 SLC6A3 (0.72) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL14972 0.86 HSD17B10 (0.69) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL14674824 0.85 KDM4E (0.52) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL13537487 0.84 KMT2A (0.67) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL789772 0.83 HSD17B10 (0.61) KDM4EHSD17B10LMNACYP1A2CYP2C9
SCHEMBL446340 0.83 SLC6A3 (0.60) KDM4ELMNATSHRALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113406242-A Detection method of aspirin-related substances 江苏万珺医药科技有限公司 2021-09-17 CN claimed
WO-2023137518-A1 PLATINUM COMPLEXES Western Sydney University (AU) 2023-07-27 WO disclosed
CN-113214587-B Transparent, antibacterial organic glass and its manufacturing method 浙江华帅特新材料科技有限公司 2022-06-03 CN disclosed
CN-113406242-A Detection method of aspirin-related substances 江苏万珺医药科技有限公司 2021-09-17 CN disclosed
CN-113214587-A Transparent, antibacterial organic glass and its manufacturing method 浙江华帅特新材料科技有限公司 2021-08-06 CN disclosed
US-20170190726-A9 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2017-07-06 US disclosed
US-20160326200-A1 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR UNIV GEORGIA (US) 2016-11-10 US disclosed
EP-3080137-A1 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR The University Of Georgia Research Foundation, Inc (US) 2016-10-19 EP disclosed
US-9351980-B2 Di-aspirin derivatives THE UNIVERSITY OF WOLVERHAMPTON (GB) 2016-05-31 US disclosed
WO-2015089389-A1 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2015-06-18 WO disclosed
US-20130035317-A1 Di-Aspirin Derivatives THE UNIVERISTY OF WOLVERHAMPTON (GB) 2013-02-07 US disclosed
WO-2011098839-A2 DI-ASPIRIN DERIVATIVES THE UNIVERSITY OF WOLVERHAMPTON (GB) 2011-08-18 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-20170190726-A9 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR PTGS1, PTGES, PTGIS KDM4E 3915/4885HSD17B10 3107/4885LMNA 4674/4885
US-20160326200-A1 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR PTGS1, PTGES, PTGIS KDM4E 3915/4885HSD17B10 3107/4885LMNA 4674/4885
US-20130035317-A1 Di-Aspirin Derivatives SDHA, DLD, DPYD KDM4E 2764/4885HSD17B10 987/4885LMNA 4485/4885

“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.