SCHEMBL210494

SCHEMBL210494

O=Cc1ccc2c(c1)OCCO2

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.77
HSD17B10 Q99714 2/20 0.77
TDP1 Q9NUW8 1/20 0.77
KDM4E B2RXH2 3/20 0.58
DYRK1A Q13627 2/20 0.54
DYRK2 Q92630 2/20 0.54
DYRK1B Q9Y463 2/20 0.54
GSK3B P49841 1/20 0.51
RAB9A P51151 5/20 0.50
MAPT P10636 4/20 0.50
NPC1 O15118 3/20 0.50
NPSR1 Q6W5P4 1/20 0.49
HPGD P15428 2/20 0.49
CXCL12 P48061 1/20 0.47
ATM Q13315 2/20 0.46
TSHR P16473 1/20 0.46
CYP3A4 P08684 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL30576999 1.00 ALDH1A1 (0.77) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
Ammonia Solution, Strong SCHEMBL28566017 0.98 ALDH1A1 (0.74) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL16784221 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL30523585 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL1247490 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL14787821 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL14777332 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL14777264 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL16784222 0.94 ALDH1A1 (0.69) ALDH1A1HSD17B10TDP1KDM4EDYRK1A
SCHEMBL3516862 0.92 ALDH1A1 (0.71) ALDH1A1HSD17B10TDP1KDM4EDYRK1A

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 1739 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110467605-B Preparation method of novel triarylpyrazoline derivatives and application of novel triarylpyrazoline derivatives in anticancer drugs 南京大学 2022-07-29 CN claimed
CN-113005774-B Preparation method and antibacterial application of thiosemicarbazone-Cu (II) complex molecule covalent grafting acrylic fiber 武汉纺织大学 2022-03-18 CN claimed
CN-113735769-A Quinolinone alkaloid derivative containing acylhydrazone structure at 3-position and preparation method and application thereof 太原理工大学 2021-12-03 CN claimed
CN-113005774-A Preparation method and antibacterial application of thiosemicarbazone-Cu (II) complex molecule covalent grafting acrylic fiber 武汉纺织大学 2021-06-22 CN claimed
US-20210171507-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS GENZYME CORPORATION 2021-06-10 US claimed
CN-108822072-B Method for preparing Elligusurgitol 中国医学科学院药物研究所 2021-01-12 CN claimed
US-20190322649-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS GENZYME CORPORATION 2019-10-24 US claimed
CN-108822072-A A method of preparing Yi Ligelusita 中国医学科学院药物研究所 2018-11-16 CN claimed
US-20170334888-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS GENZYME CORPORATION 2017-11-23 US claimed
CN-105801556-A Preparation method of 2,3-dihydro-1,4-benzodioxane-6-carboxylic acid compound 上海药谷药业有限公司 2016-07-27 CN claimed
EP-1075833-B1 Barrier cream SECR DEFENCE (GB) 2005-04-13 EP claimed
US-20040132807-A1 Aurones as telomerase inhibitors PHARMACIA ITALIA SPA (IT) 2004-07-08 US claimed
EP-1358169-A2 DIAMINOTHIAZOLES AND THEIR USE AS INHIBITORS OF CYCLIN-DEPENDENT KINASE F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP claimed
WO-2002057261-A2 DIAMINOTHIAZOLES AND THEIR USE AS INHIBITORS OF CYCLIN-DEPENDENT KINASE F. HOFFMANN-LA ROCHE AG (CH) 2002-07-25 WO claimed
US-6309631-B1 OIL-BASED BASE CREAM, 40-50% W/W OF A 1:1 W/W MIXTURE OF TITANIUM DIOXIDE AND FERRIC OXIDE AND FROM 0 TO 20% W/W OF A MELT ADDITIVE; MITIGATION OF BURNS SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2001-10-30 US claimed
EP-1075833-A1 Barrier cream THE SECRETARY OF STATE FOR DEFENCE (GB) 2001-02-14 EP claimed
US-4582903-A Synthesis of unsaturated hydantoins with an inexpensive catalyst STAUFFER CHEMICAL COMPANY (US) 1986-04-15 US claimed
EP-0031253-B1 PROCESS FOR PREPARING 3,4-SUBSTITUTED BENZALDEHYDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-10-05 EP claimed
US-4345072-A Process for the production of 5-arylidene hydantoins (B) DEGUSSA AG (DE) 1982-08-17 US claimed
EP-0031253-A1 Process for preparing 3,4-substituted benzaldehydes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-07-01 EP claimed

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

For each of this compound's patents that has machine-readable text (4 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-20210171507-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS UGCG, UGGT1, DPAGT1 ALDH1A1 1857/4885HSD17B10 873/4885TDP1 3429/4885
US-20170334888-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS UGCG, UGGT1, DPAGT1 ALDH1A1 1857/4885HSD17B10 873/4885TDP1 3429/4885
US-20190322649-A1 SYNTHESIS OF UDP-GLUCOSE: N-ACYLSPHINGOSINE GLUCOSYLTRANSFERASE INHIBITORS UGCG, UGGT1, DPAGT1 ALDH1A1 1857/4885HSD17B10 873/4885TDP1 3429/4885
US-20040132807-A1 Aurones as telomerase inhibitors TERT, TERF2, TERF2IP ALDH1A1 1344/4885HSD17B10 3179/4885TDP1 13/4885

“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.