SCHEMBL4380935

SCHEMBL4380935

CCc1c(OCOC)cc(OCOC)c(-c2ccccc2)c1CCOCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.39
FABP3 P05413 3/20 0.38
FABP4 P15090 3/20 0.38
FABP5 Q01469 2/20 0.38
PTGDR2 Q9Y5Y4 5/20 0.35
FFAR4 Q5NUL3 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GLA P06280 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FABP1 P07148 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
PLA2G1B P04054 1/20 0.33
DHODH Q02127 1/20 0.32
MPO P05164 1/20 0.32
CLCN2 P51788 1/20 0.32

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
SCHEMBL4378212 0.94 EGFR (0.38) EGFRFABP3FABP4FABP5PTGDR2
SCHEMBL4380474 0.91 DPP4 (0.39) EGFRFABP3FABP4FABP5PLA2G1B
SCHEMBL4392320 0.89 EGFR (0.36) EGFRFABP3FABP4FABP5SMN1; SMN2
SCHEMBL4386915 0.89 EGFR (0.36) EGFRFABP3FABP4FABP5POLB
SCHEMBL4382068 0.87 EGFR (0.35) EGFRSMN1; SMN2L3MBTL1
SCHEMBL4387419 0.86 EGFR (0.38) EGFRSMN1; SMN2DHODH
SCHEMBL4387139 0.86 EGFR (0.42) EGFRGLA
SCHEMBL4379642 0.86 EGFR (0.37) EGFRCLCN2
SCHEMBL4384888 0.85 DPP4 (0.39) EGFRFABP3FABP4FABP5PLA2G1B
SCHEMBL4384192 0.84 EGFR (0.34) EGFR

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 624/4885FABP3 2603/4885FABP4 3632/4885

“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.