SCHEMBL4386967

SCHEMBL4386967

COCCc1c(Br)c(OCOC)cc(OCOC)c1-c1cccc(OC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.37
DYRK1A Q13627 1/20 0.37
MAOB P27338 4/20 0.36
CYP2C19 P33261 4/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2D6 P10635 3/20 0.36
TSHR P16473 2/20 0.36
HIF1A Q16665 1/20 0.36
GCGR P47871 1/20 0.36
CYP1A2 P05177 3/20 0.35
PTPN1 P18031 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
ATM Q13315 1/20 0.34
MAPT P10636 1/20 0.34
DCTPP1 Q9H773 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
SCHEMBL2864914 0.86 EGFR (0.37) SMN1; SMN2MAPTNPC1TP53HPGD
SCHEMBL4381703 0.84 CYP3A4 (0.33) CLK4DYRK1ACYP2C19CYP3A4CYP2D6
SCHEMBL4384874 0.83 MAOA (0.35) MAOBCYP2C19CYP2D6CYP1A2ALDH1A1
SCHEMBL4383654 0.82 NPC1 (0.38) CYP2C19CYP3A4CYP2D6TSHRHIF1A
SCHEMBL4394964 0.82 EGFR (0.43) LMNAERN1
SCHEMBL4382471 0.81 GRIN1 (0.40) ALDH1A1LMNAMAPTNPC1HPGD
SCHEMBL4385704 0.81 FYN (0.43) ERN1
SCHEMBL4384793 0.81 EGFR (0.35) ALDH1A1SMN1; SMN2LMNAMAPTTP53
SCHEMBL4389002 0.80 GRIN1 (0.38) ALDH1A1LMNAMAPTNPC1HPGD
SCHEMBL4386995 0.79 EGFR (0.36) MAPT

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 CLK4 3220/4885DYRK1A 2056/4885MAOB 3920/4885

“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.