SCHEMBL4390010

SCHEMBL4390010

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.39
DHODH Q02127 1/20 0.34
CLCN2 P51788 1/20 0.34
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
FYN P06241 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33
IGF1R P08069 1/20 0.33
MET P08581 1/20 0.33
PDGFRB P09619 1/20 0.33
PIM1 P11309 1/20 0.33
FGFR1 P11362 1/20 0.33
PRKACA P17612 1/20 0.33
LTK P29376 1/20 0.33
GRK5 P34947 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
SCHEMBL4386680 0.89 EGFR (0.38) EGFRDHODHCLCN2CHEK1AURKA
SCHEMBL4389605 0.88 HPGD (0.39) KDM4EMAPTHDAC1HDAC8HDAC6
SCHEMBL4390358 0.83 EGFR (0.38) EGFRCLCN2CHEK1AURKADAPK3
SCHEMBL4379880 0.81 EGFR (0.42) EGFRCLCN2CAPN1KDM4EMEN1
SCHEMBL4381681 0.81 EGFR (0.36) EGFRKDM4EMEN1ALDH1A1MAPT
SCHEMBL4386776 0.81 EGFR (0.43) EGFRCLCN2PIM1CAPN1KDM4E
SCHEMBL4384148 0.80 EGFR (0.40) EGFRCLCN2CAPN1KDM4EMEN1
SCHEMBL4387139 0.79 EGFR (0.42) EGFRCAPN1
SCHEMBL4394924 0.79 CNR2 (0.38) EGFRDHODHCYP2C19HDAC3HDAC4
SCHEMBL4385894 0.78 EGFR (0.41) EGFRDHODHCLCN2CAPN1MAPT

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 624/4885DHODH 3584/4885CLCN2 3823/4885

“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.