SCHEMBL2865272

SCHEMBL2865272

CCc1c(OCOC)cc(OCOC)c(-c2cc(CO)ccc2OC)c1CCOC

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
POLB P06746 1/20 0.33
CTSA P10619 4/20 0.32
FFAR1 O14842 1/20 0.32
FYN P06241 1/20 0.32
MAPT P10636 2/20 0.31
MAPK10 P53779 1/20 0.31
GABRA1 P14867 3/20 0.31
GABRB2 P47870 3/20 0.31
ALOX5 P09917 1/20 0.31
HTT P42858 1/20 0.30
EGFR P00533 1/20 0.30

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
SCHEMBL2861629 0.83 PTGES (0.37) MAPTHTT
SCHEMBL2862935 0.81 FYN (0.40) FFAR1FYNEGFR
SCHEMBL2857280 0.80 EGFR (0.33) EGFR
SCHEMBL4379642 0.73 EGFR (0.37) MAPTEGFR
SCHEMBL6301878 0.70 POLB (0.56) NPC1RAB9APOLBFYNMAPT
SCHEMBL4387756 0.70 ALDH1A1 (0.34) NPC1RAB9AMAPT
SCHEMBL2869133 0.69 FYN (0.42) FFAR1FYNEGFR
SCHEMBL2864980 0.69
SCHEMBL4384782 0.69
SCHEMBL4382068 0.68 EGFR (0.35) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642880-B1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KIRIN CO LTD (JP) 2013-09-04 EP disclosed
US-7767693-B2 Hsp90 family protein inhibitors KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-08-03 US disclosed
US-20090247522-A1 Hsp90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-10-01 US disclosed
US-7538224-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070032532-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-02-08 US disclosed
EP-1642880-A1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-04-05 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 (2 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-20070032532-A1 Hsp90 family protein inhibitors HSP90AB1, HSP90B1, HSP90AB2P DHFR 3641/4885NPC1 1079/4885RAB9A 1598/4885
US-20090247522-A1 Hsp90 FAMILY PROTEIN INHIBITORS HSP90AB1, HSP90B1, HSP90AB2P DHFR 3641/4885NPC1 1079/4885RAB9A 1598/4885

“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.