SCHEMBL4386776

SCHEMBL4386776

CCc1c(OCOC)cc(OCOC)c(-c2ccccc2)c1CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FABP3 P05413 2/20 0.37
FABP4 P15090 2/20 0.37
FABP5 Q01469 1/20 0.37
GAA P10253 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PIM1 P11309 1/20 0.37
CLCN2 P51788 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.34
GCGR P47871 1/20 0.34
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL4379880 0.90 EGFR (0.42) EGFRSMN1; SMN2MEN1KMT2AGAA
SCHEMBL4387139 0.88 EGFR (0.42) EGFRLMNACAPN1
SCHEMBL4385950 0.85 EGFR (0.43) EGFRSMN1; SMN2MEN1KMT2AGAA
SCHEMBL4383171 0.85 PTGER1 (0.48) SMN1; SMN2
SCHEMBL4381860 0.84 EGFR (0.40) EGFRPOLB
SCHEMBL4385894 0.84 EGFR (0.41) EGFRFABP3FABP4FABP5CLCN2
SCHEMBL4380935 0.83 EGFR (0.39) EGFRSMN1; SMN2FABP3FABP4FABP5
SCHEMBL4381984 0.83 EGFR (0.41) EGFRFABP3FABP4FABP5GAA
SCHEMBL4384148 0.83 EGFR (0.40) EGFRMEN1KMT2AKDM4ECLCN2
SCHEMBL4390358 0.82 EGFR (0.38) EGFRMEN1KMT2AFABP3FABP4

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 EGFR 624/4885SMN1; SMN2 4471/4885MEN1 4784/4885

“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.