SCHEMBL4381365

SCHEMBL4381365

COCOc1cc(OCOC)c(-c2ccc(C=CC(=O)OC)o2)c(CC(=O)OC)c1Br

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.32
ALDH1A1 P00352 5/20 0.32
MAPT P10636 5/20 0.32
POLB P06746 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
BLM P54132 1/20 0.32
AKR1C3 P42330 1/20 0.32
BACE1 P56817 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 2/20 0.30
GAA P10253 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL4381362 1.00 FDPS (0.32) FDPSALDH1A1MAPTPOLBMEN1
SCHEMBL4392077 0.92 MAPT (0.35) FDPSALDH1A1MAPTPOLBMEN1
SCHEMBL4392073 0.92 MAPT (0.35) FDPSALDH1A1MAPTPOLBMEN1
SCHEMBL4384159 0.88 ALDH1A1 (0.37) ALDH1A1MAPTPOLBHPGDKDM4E
SCHEMBL4384014 0.82 ALDH1A1 (0.34) FDPSALDH1A1MAPTPOLBMEN1
SCHEMBL4384018 0.82 ALDH1A1 (0.34) FDPSALDH1A1MAPTPOLBMEN1
SCHEMBL4388730 0.81 ALDH1A1 (0.34) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL4394113 0.80 MAPT (0.33) ALDH1A1MAPTMEN1KMT2ACYP2C19
SCHEMBL4379675 0.77 ALDH1A1 (0.39) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL4381375 0.75 HSP90AB1 (0.39) ALDH1A1MAPTMEN1KMT2ABACE1

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 FDPS 2911/4885ALDH1A1 3520/4885MAPT 2443/4885

“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.