SCHEMBL6724702

SCHEMBL6724702

CCCOc1ccc(Cc2c(C)cc(OC(C)=O)cc2O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.47
SLC5A2 P31639 1/20 0.47
THRA P10827 5/20 0.47
THRB P10828 5/20 0.47
LMNA P02545 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LTA4H P09960 1/20 0.41
PLK1 P53350 1/20 0.41
CYP1A2 P05177 2/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
ACACB O00763 2/20 0.41
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CYP2D6 P10635 1/20 0.39
PDE4A P27815 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL27767721 0.90 THRA (0.49) SLC5A1SLC5A2THRATHRBKMT2A
SCHEMBL4797378 0.86 THRA (0.49) THRATHRBLMNAMAPK1KMT2A
SCHEMBL27746660 0.85 THRA (0.48) SLC5A1SLC5A2THRATHRBL3MBTL1
SCHEMBL27767713 0.84 THRA (0.50) SLC5A1SLC5A2THRATHRBLMNA
SCHEMBL27767686 0.82 THRA (0.48) THRATHRBLMNAKMT2AKDM4E
SCHEMBL27746702 0.82 THRA (0.48) THRATHRBLMNAMAPK1PTGS1
SCHEMBL27746659 0.82 THRA (0.48) THRATHRBLMNAL3MBTL1KMT2A
SCHEMBL27746689 0.81 THRA (0.44) THRATHRBLMNAKMT2AACACB
SCHEMBL27746654 0.79 SLC5A1 (0.41) SLC5A1SLC5A2LMNAL3MBTL1PLK1
SCHEMBL27767700 0.78 THRA (0.44) THRATHRBMAPK1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472937-A Benzylphenylglucopyranoside Derivatives DAIICHI SANKYO CO LTD (JP) 2009-07-01 CN disclosed
CN-1177857-C Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives ����ҩƷ��ҵ��ʽ���� 2004-12-01 CN disclosed
US-20040053855-A1 Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives KISSEI PHARMACEUTICAL CO & LTD. (JP) 2004-03-18 US disclosed
CN-1418219-A Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives KISSEI PHARMACEUTICAL (JP) 2003-05-14 CN disclosed
EP-1270584-A1 GLUCOPYRANOSYLOXY BENZYLBENZENE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THE PREPARATION OF THE DERIVATIVES Kissei Pharmaceutical Co., Ltd. (JP) 2003-01-02 EP 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 (1 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-20040053855-A1 Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives SLC5A2, SLC5A1, SLC2A2 SLC5A1 2/4885SLC5A2 1/4885THRA 3338/4885

“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.