SCHEMBL4382034

SCHEMBL4382034

CCOC(=O)CCc1ccc(-c2c(O)cc(O)cc2COCc2ccccc2)o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 3/20 0.36
HSD17B10 Q99714 2/20 0.36
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DAO P14920 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALOX5 P09917 1/20 0.35
HTR2B P41595 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL4387670 0.76 LDHA (0.39) ALDH1A1KDM4EHPGDTDP1POLB
SCHEMBL4383921 0.73 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4394951 0.72 HDAC1 (0.43) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4381914 0.70 POLB (0.45) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4389601 0.70 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL17537839 0.69 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1KDM4EHPGD
SCHEMBL4385682 0.67 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4387564 0.67 ALDH1A1 (0.35) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4387566 0.67 ALDH1A1 (0.35) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL4390435 0.67 KDM4E (0.39) ALDH1A1KDM4EHPGDTDP1HSD17B10

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 CYP4F2 2547/4885CYP4A11 1072/4885ALDH1A1 3520/4885

“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.