SCHEMBL4389366

SCHEMBL4389366

COC(=O)Cc1cc(OCc2ccccc2)cc(OCc2ccccc2)c1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MTNR1A P48039 3/20 0.44
MTNR1B P49286 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PTGER1 P34995 1/20 0.44
PTGER4 P35408 1/20 0.44
PTGER3 P43115 1/20 0.44
PTGER2 P43116 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SMPD1 P17405 2/20 0.42
PIN1 Q13526 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
FFAR1 O14842 2/20 0.42
MAOB P27338 2/20 0.41

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
SCHEMBL2866502 0.84 EGFR (0.43) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL4381103 0.83 MTNR1A (0.45) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL5446276 0.82 L3MBTL1 (0.53) ALDH1A1MTNR1AMTNR1BL3MBTL1NPC1
SCHEMBL4384140 0.82 EGFR (0.46) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL20954700 0.79 MTNR1A (0.58) ALDH1A1MTNR1AMTNR1BL3MBTL1NPC1
SCHEMBL4380021 0.78 CYP4F2 (0.52) MEN1KMT2AL3MBTL1PTGER1PTGER4
SCHEMBL31757763 0.77 L3MBTL1 (0.56) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL9204780 0.77 LTB4R (0.55) MEN1KMT2AALDH1A1L3MBTL1NPC1
SCHEMBL2988197 0.77 L3MBTL1 (0.56) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL490786 0.77 MEN1 (0.59) MEN1KMT2AALDH1A1L3MBTL1NPC1

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 MEN1 4784/4885KMT2A 3994/4885ALDH1A1 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.