SCHEMBL1097902

SCHEMBL1097902

COc1ccc(CC(=O)O)c(OC)c1

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.75
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
APLNR P35414 1/20 0.56
PTGS1 P23219 1/20 0.56
AKR1C3 P42330 1/20 0.56
AKR1C2 P52895 1/20 0.56
KDM4E B2RXH2 3/20 0.55
POLB P06746 1/20 0.53
LCK P06239 1/20 0.52
ALDH1A1 P00352 2/20 0.50
NR1H4 Q96RI1 1/20 0.50
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 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
SCHEMBL30831943 1.00 HSD17B10 (0.75) HSD17B10MEN1KMT2AAPLNRPTGS1
Hydrochloric Acid SCHEMBL2527027 0.98 HSD17B10 (0.73) HSD17B10MEN1KMT2AAPLNRPTGS1
SCHEMBL23229043 0.87 HSD17B10 (0.62) HSD17B10MEN1KMT2APTGS1AKR1C3
SCHEMBL267732 0.86 CYP3A4 (0.62) HSD17B10MEN1KMT2AAPLNRALDH1A1
SCHEMBL504029 0.86 HSD17B10 (1.00) HSD17B10MEN1KMT2APTGS1AKR1C3
SCHEMBL29392677 0.86 CYP3A4 (0.62) HSD17B10MEN1KMT2AAPLNRALDH1A1
SCHEMBL30512021 0.86 HSD17B10 (1.00) HSD17B10MEN1KMT2APTGS1AKR1C3
SCHEMBL6175515 0.85 CAMK2A (0.68) HSD17B10MEN1KMT2APTGS1AKR1C3
SCHEMBL23229241 0.84 HSD17B10 (0.59) HSD17B10MEN1KMT2APTGS1AKR1C3
SCHEMBL11577618 0.84 HSD17B10 (0.63) HSD17B10MEN1KMT2APTGS1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103030647-B Method for synthesizing glabridin SHANDONG ANALYSIS TEST CENTER (CN) 2014-10-29 CN claimed
WO-2005054169-A1 PREPARATION METHOD OF 2-PHENYLACETOPHENONE DERIVATIVES HANBUL COSMETIC CO., LTD. (KR) 2005-06-16 WO claimed
CN-112682031-B Oil field interwell tracer, tracing method and fracturing fluid 中国石油化工股份有限公司 2024-06-28 CN disclosed
CN-117964633-B Preparation method of glabridin 深圳创元生物医药科技有限公司 2024-06-21 CN disclosed
CN-117964633-B Preparation method of glabridin 深圳创元生物医药科技有限公司 2024-06-21 CN disclosed
CN-117964633-A Preparation method of glabridin 深圳创元生物医药科技有限公司 2024-05-03 CN disclosed
CN-117964633-A Preparation method of glabridin 深圳创元生物医药科技有限公司 2024-05-03 CN disclosed
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 US disclosed
EP-3157938-B1 HETERO FUNCTIONAL BINDING SYSTEMS ANTEO TECH PTY LTD (AU) 2022-03-16 EP disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 US disclosed
CN-112682031-A Oil field interwell tracer, tracing method and fracturing fluid 中国石油化工股份有限公司 2021-04-20 CN disclosed
EP-0714299-A4 1996-07-10 EP disclosed
EP-0714299-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1996-06-05 EP disclosed
US-5470854-A Antiestrogens SCHERING AKTIENGESELLSCHAFT (DE) 1995-11-28 US disclosed
US-5464788-A Stopping labor MERCK & CO., INC. (US) 1995-11-07 US disclosed
WO-1995025443-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-09-28 WO disclosed
WO-1995002405-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
EP-0516257-A1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-02 EP disclosed
US-4497815-A 1-(N-Substituted carbamoyl)-5-fluorouracil derivatives and the carcinostatic agents containing same as active ingredients Ozaki, Shoichiro (JP) 1985-02-05 US disclosed
US-4493823-A USING CARBOXYBENZENE COMPOUND HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1985-01-15 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-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN HSD17B10 368/4885MEN1 2645/4885KMT2A 2804/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN HSD17B10 368/4885MEN1 2645/4885KMT2A 2804/4885

“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.