SCHEMBL4387412

SCHEMBL4387412

COC(=O)C(c1cc(O)cc(O)c1)c1ccc2c(c1)OCO2

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 9/20 0.59
TAS1R3 Q7RTX0 4/20 0.47
TAS1R1 Q7RTX1 4/20 0.47
KMT2A Q03164 1/20 0.47
CYP3A4 P08684 1/20 0.46
KDM4E B2RXH2 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL4381527 0.80 EDNRA (0.53) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL2862126 0.80 EDNRA (0.52) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL22404286 0.80 EDNRA (0.56) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL12825470 0.79 EDNRA (0.56) EDNRATAS1R3TAS1R1KMT2AKDM4E
SCHEMBL1746047 0.79 PTGS2 (0.56) EDNRATAS1R3TAS1R1KMT2AALDH1A1
SCHEMBL805660 0.79 EDNRA (0.55) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL10204938 0.77 EDNRA (0.54) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL14032401 0.77 EDNRA (0.54) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL4996294 0.77 EDNRA (0.54) EDNRATAS1R3TAS1R1KMT2ACYP3A4
SCHEMBL805662 0.77 EDNRA (0.54) EDNRATAS1R3TAS1R1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P EDNRA 2365/4885TAS1R3 1883/4885TAS1R1 1538/4885

“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.