SCHEMBL4380474

SCHEMBL4380474

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

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.39
EGFR P00533 2/20 0.38
DHODH Q02127 1/20 0.33
CAPN1 P07384 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33
HTT P42858 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ACACA Q13085 2/20 0.32
KDM4E B2RXH2 1/20 0.32
PLA2G1B P04054 3/20 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
SCHEMBL4384888 0.94 DPP4 (0.39) DPP4EGFRDHODHCAPN1MEN1
SCHEMBL4380935 0.91 EGFR (0.39) EGFRDHODHFABP3FABP4FABP5
SCHEMBL4385894 0.88 EGFR (0.41) DPP4EGFRDHODHCAPN1FABP3
SCHEMBL4392320 0.88 EGFR (0.36) EGFRCAPN1MEN1KMT2AFABP3
SCHEMBL4386915 0.88 EGFR (0.36) EGFRFABP3FABP4FABP5KDM4E
SCHEMBL4382068 0.85 EGFR (0.35) EGFRMEN1KMT2A
SCHEMBL4378212 0.85 EGFR (0.38) EGFRMEN1KMT2AFABP3FABP4
SCHEMBL4387419 0.84 EGFR (0.38) EGFRDHODHMEN1KMT2ACYP3A4
SCHEMBL4387139 0.84 EGFR (0.42) EGFRCAPN1
SCHEMBL4379642 0.84 EGFR (0.37) EGFRKDM4E

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 DPP4 4407/4885EGFR 624/4885DHODH 3584/4885

“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.