SCHEMBL4394084

SCHEMBL4394084

COC(=O)C(Br)c1cc(O)cc(O)c1-c1ccco1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 2/20 0.36
POLB P06746 2/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36
CFTR P13569 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
TACR3 P29371 1/20 0.35
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.34

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
SCHEMBL4379804 0.79 PDE4B (0.41) HSP90AA1MAPTNPSR1
SCHEMBL4387065 0.74 MAPT (0.35) L3MBTL1TDP1POLBTSHRKDM4E
SCHEMBL4379685 0.74 L3MBTL1 (0.37) L3MBTL1TDP1POLBRAB9ANPC1
SCHEMBL4384857 0.72 EGFR (0.42) L3MBTL1TDP1POLBCTDSP1CFTR
SCHEMBL11276948 0.66 KMT2A (0.50) L3MBTL1TSHRMAPTALDH1A1
SCHEMBL4394076 0.65 ALDH1A1 (0.42) L3MBTL1TDP1POLBRAB9ANPC1
SCHEMBL22980154 0.64 KMT2A (0.44) ALDH1A1
SCHEMBL9127138 0.64 KMT2A (0.44) L3MBTL1RAB9ANPC1TSHRNPSR1
SCHEMBL4384861 0.63 ALDH1A1 (0.38) L3MBTL1TDP1POLBKDM4EMAPT
SCHEMBL4387624 0.63 PDE4B (0.41) HSP90AA1MAPTNPSR1

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 L3MBTL1 3218/4885TDP1 2978/4885POLB 3913/4885

“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.