SCHEMBL4545347

SCHEMBL4545347

COc1cc(C(=O)C(O)CO)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
SLC22A6 Q4U2R8 1/20 0.60
SLC22A8 Q8TCC7 1/20 0.60
MEN1 O00255 1/20 0.60
RAB9A P51151 1/20 0.60
HTT P42858 1/20 0.58
HSD17B2 P37059 1/20 0.55
CYP3A4 P08684 2/20 0.54
TSHR P16473 2/20 0.54
BLM P54132 2/20 0.54
CYP1A2 P05177 1/20 0.54
HSP90AA1 P07900 1/20 0.54
HSP90AB1 P08238 1/20 0.54
KDM4E B2RXH2 1/20 0.52
POLB P06746 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
MMP1 P03956 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GAA P10253 1/20 0.48
CYP2D6 P10635 1/20 0.47

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
SCHEMBL29131378 0.84 SLC22A6 (0.55) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL28052189 0.82 MEN1 (0.66) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL670562 0.82 PKM (0.55) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL11539489 0.81 MEN1 (0.64) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL5702623 0.80 HTR1A (0.56) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL6835992 0.80 MEN1 (0.68) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL670290 0.80 KDM4E (0.58) KDM4EPOLBHDAC6GAA
SCHEMBL30393910 0.78 BLM (0.69) KMT2ASLC22A6SLC22A8MEN1RAB9A
Vanillic Acid SCHEMBL20481367 0.78 HTT (0.71) KMT2ASLC22A6SLC22A8MEN1RAB9A
SCHEMBL15004192 0.78 MEN1 (0.64) KMT2ASLC22A6SLC22A8MEN1RAB9A

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
CN-102872064-A Method for extracting alpha-glucosidase activity inhibitor from lycium barbarum seeds and residues after extraction of lycium barbarum oil from lycium barbarum seeds and application thereof NINGXIA INST FOR DRUG CONTROL 2013-01-16 CN claimed
US-11826396-B2 Nutriprotective diet FEDERATION DES PRODUCTEURS ACERICOLES DU QUEBEC (CA) 2023-11-28 US disclosed
US-20190070245-A1 NUTRIPROTECTIVE DIET FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2019-03-07 US disclosed
CN-102872064-B Seed of Fructus Lycii and extract method extracting alpha-glucosidase activity inhibitor and uses thereof in the residue after Lycium-seed-oil NINGXIA HUI AUTONOMOUS PREFECTURE INSTITUTE FOR DRUG CONTROL (CN) 2015-08-19 CN disclosed
US-20150140143-A1 NUTRIPROTECTIVE DIET FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2015-05-21 US disclosed
US-20150140143-A1 NUTRIPROTECTIVE DIET FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2015-05-21 US disclosed
US-20130267474-A1 NOVEL PHYTOCHEMICALS FROM EXTRACTS OF MAPLE SYRUPS AND MAPLE TREES AND USES THEREOF UNIVERSITY OF RHODE ISLAND (US) 2013-10-10 US disclosed
US-20130203688-A1 SUGAR PLANT DERIVED BY-PRODUCTS AND METHODS OF PRODUCTION THEREOF FÉDÉRATION DES PRODUCTEURS ACÉRI-COLES DU QUÉBEC (CA) 2013-08-08 US disclosed
WO-2013033828-A1 NUTRIPROTECTIVE DIET FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2013-03-14 WO disclosed
CN-102872064-A Method for extracting alpha-glucosidase activity inhibitor from lycium barbarum seeds and residues after extraction of lycium barbarum oil from lycium barbarum seeds and application thereof NINGXIA INST FOR DRUG CONTROL 2013-01-16 CN disclosed
WO-2012055010-A1 MAPLE TREE-DERIVED PRODUCTS AND USES THEREOF FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2012-05-03 WO disclosed
WO-2012021983-A1 SUGAR PLANT DERIVED BY-PRODUCTS AND METHODS OF PRODUCTION THEREOF FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2012-02-23 WO disclosed
WO-2012021981-A1 NOVEL PHYTOCHEMICALS FROM EXTRACTS OF MAPLE SYRUPS AND MAPLE TREES AND USES THEREOF FÉDÉRATION DES PRODUCTEURS ACÉRICOLES DU QUÉBEC (CA) 2012-02-23 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 (5 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-11826396-B2 Nutriprotective diet NEFM, NNMT, SORD KMT2A 3107/4885SLC22A6 60/4885SLC22A8 428/4885
US-20130267474-A1 NOVEL PHYTOCHEMICALS FROM EXTRACTS OF MAPLE SYRUPS AND MAPLE TREES AND USES THEREOF BPHL, OAT, PSAT1 KMT2A 4123/4885SLC22A6 2926/4885SLC22A8 2375/4885
US-20130203688-A1 SUGAR PLANT DERIVED BY-PRODUCTS AND METHODS OF PRODUCTION THEREOF SORD, TREH, CUTA KMT2A 2406/4885SLC22A6 142/4885SLC22A8 340/4885
US-20190070245-A1 NUTRIPROTECTIVE DIET NEFM, NNMT, SORD KMT2A 3107/4885SLC22A6 60/4885SLC22A8 428/4885
US-20150140143-A1 NUTRIPROTECTIVE DIET NEFM, NNMT, SORD KMT2A 3298/4885SLC22A6 68/4885SLC22A8 452/4885

“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.