SCHEMBL4392519

SCHEMBL4392519

NC(=O)c1c(Br)c(O)cc(O)c1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.39
HTT P42858 1/20 0.39
MAP2 P11137 3/20 0.37
BCAT2 O15382 1/20 0.37
DHODH Q02127 1/20 0.37
IKBKB O14920 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
AKR1C4 P17516 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36

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
SCHEMBL4387282 0.86 PRNP (0.42) HTTCA1CA2AKR1C4AKR1C3
SCHEMBL4389613 0.83 CNR2 (0.48) RAB9AMEN1GAAKMT2AALDH1A1
SCHEMBL4390351 0.80 GSK3B (0.40) RAB9AHTTIKBKBGAAALDH1A1
SCHEMBL4381542 0.80 SMN1; SMN2 (0.44) RAB9AHTTMEN1GAAKMT2A
SCHEMBL4389590 0.80 LMNA (0.50) RAB9AHTTMEN1KMT2AALDH1A1
SCHEMBL4385905 0.80 ALDH1A1 (0.43) RAB9AHTTMEN1KMT2AALDH1A1
SCHEMBL4392444 0.76 PLA2G2A (0.41) RAB9AHTTGAAALDH1A1MAPT
SCHEMBL4380841 0.75 EGFR (0.49) KMT2AALDH1A1TSHRHPGD
SCHEMBL4384039 0.74 PDE4B (0.47) HTTMEN1KMT2AALDH1A1MAPT
SCHEMBL17292696 0.73 MEN1 (0.52) RAB9AHTTMAP2BCAT2DHODH

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 RAB9A 585/4885HTT 538/4885MAP2 1371/4885

“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.