SCHEMBL4388923

SCHEMBL4388923

COCOc1cc(CC(=O)OC)c(-c2ccc3ccccc3c2)c(OCOC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
SLC6A2 P23975 4/20 0.39
SLC6A3 Q01959 4/20 0.39
SLC6A4 P31645 1/20 0.39
EGFR P00533 2/20 0.37
ACLY P53396 1/20 0.37
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
GRM5 P41594 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
ERN1 O75460 1/20 0.36
ALPL P05186 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34

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
SCHEMBL4384140 0.88 EGFR (0.46) EGFRACLYHTTSMN1; SMN2
SCHEMBL2866502 0.88 EGFR (0.43) EGFRACLYGRM5MTNR1AMTNR1B
SCHEMBL4386233 0.85 EGFR (0.39) EGFRACLYERN1SMN1; SMN2PPARG
SCHEMBL4390545 0.85 ROR1 (0.43) EGFRCYP11B1CYP11B2
SCHEMBL4378484 0.84 FFAR4 (0.38) EGFRACLYPPARG
SCHEMBL4378269 0.83 EGFR (0.38) SLC6A3EGFRACLYPOLB
SCHEMBL4386175 0.82 L3MBTL1 (0.40) MTNR1AMTNR1B
SCHEMBL4381523 0.82 ALDH1A1 (0.47) ERN1SMN1; SMN2
SCHEMBL4390340 0.82 CFD (0.38) CDK8EGFRHTTSMN1; SMN2
SCHEMBL4389611 0.82 FYN (0.43) EGFRACLYMTNR1AMTNR1B

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 CCNC 1769/4885CDK8 315/4885SLC6A2 2571/4885

“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.