SCHEMBL4386604

SCHEMBL4386604

COCCNC(=O)Cc1c(Br)c(O)cc(O)c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.49
KDM4E B2RXH2 4/20 0.49
GLA P06280 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CA2 P00918 1/20 0.47
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK1 P28482 1/20 0.42
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL4394879 0.86 HPGD (0.44) HPGDKDM4EL3MBTL1CA2ALDH1A1
SCHEMBL4390425 0.85 MTNR1A (0.41) HPGDL3MBTL1POLBKMT2AMEN1
SCHEMBL4382263 0.83 MAPT (0.47) KDM4ECA2CYP1A2CYP2C19ALOX15
SCHEMBL4379801 0.82 L3MBTL1 (0.43) HPGDKDM4EL3MBTL1RAB9ANPC1
SCHEMBL4389225 0.81 HPGD (0.43) HPGDKDM4EALDH1A1SMN1; SMN2KMT2A
SCHEMBL4387558 0.81 ADRB2 (0.40) HPGDKDM4EL3MBTL1ALOX15
SCHEMBL4388905 0.81 HPGD (0.37) HPGDKDM4ECYP2C19MAPK1ALDH1A1
SCHEMBL4388252 0.81 ADRB2 (0.42) HPGDKDM4EL3MBTL1ALOX15ALDH1A1
SCHEMBL4387272 0.80 ALDH1A1 (0.54) HPGDKDM4EL3MBTL1CA2RAB9A
SCHEMBL4396326 0.80 KDM4E (0.48) HPGDKDM4EGLAL3MBTL1CA2

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 HPGD 3238/4885KDM4E 3223/4885GLA 4173/4885

“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.