SCHEMBL4879392

SCHEMBL4879392

COC(=O)c1cccc(Oc2c[nH]nc2-c2ccc(O)cc2O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 7/20 0.44
KMT2A Q03164 7/20 0.44
MAPT P10636 6/20 0.44
LMNA P02545 4/20 0.44
TSHR P16473 3/20 0.44
GAA P10253 3/20 0.44
ALOX15 P16050 3/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
HSD17B10 Q99714 1/20 0.44
AMY1A P0DUB6 1/20 0.43
ALOX12 P18054 4/20 0.41
HIF1A Q16665 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
EGFR P00533 1/20 0.41
MET P08581 1/20 0.39

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
SCHEMBL4884397 0.89 AMY1A (0.48) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4882983 0.87 AMY1A (0.53) L3MBTL1MEN1KMT2AMAPTLMNA
SCHEMBL4877245 0.81 ALDH1A1 (0.46) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4884200 0.81 MAPT (0.49) L3MBTL1MEN1KMT2AMAPTLMNA
SCHEMBL4881472 0.81 MAPT (0.44) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4883770 0.81 KMT2A (0.51) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4881251 0.80 CA12 (0.46) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4890060 0.79 MAPT (0.58) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4881640 0.79 F10 (0.39) MEN1KMT2AMAPTLMNATSHR
SCHEMBL4881151 0.79 MAPT (0.44) MEN1KMT2AMAPTLMNATSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799649-B1 3-(2-HYDROXYPHENYL) PYRAZOLES AND THEIR USE AS HSP90 MODULATORS MERCK PATENT GMBH (DE) 2014-06-25 EP claimed
US-20080090880-A1 3-(2-Hydroxyphenyl) Pyrazoles and Thier Use as Hsp90 Modulators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-04-17 US claimed
EP-1799649-B1 3-(2-HYDROXYPHENYL) PYRAZOLES AND THEIR USE AS HSP90 MODULATORS MERCK PATENT GMBH (DE) 2014-06-25 EP disclosed
US-20080090880-A1 3-(2-Hydroxyphenyl) Pyrazoles and Thier Use as Hsp90 Modulators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-04-17 US disclosed
EP-1799649-A1 3-(2-HYDROXYPHENYL) PYRAZOLES AND THEIR USE AS HSP90 MODULATORS Merck Patent GmbH (DE) 2007-06-27 EP disclosed
WO-2006039977-A1 3-(2-HYDROXYPHENYL) PYRAZOLES AND THEIR USE AS HSP90 MODULATORS MERCK PATENT GMBH (DE) 2006-04-20 WO 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-20080090880-A1 3-(2-Hydroxyphenyl) Pyrazoles and Thier Use as Hsp90 Modulators HSP90AB1, HSP90AA1, HSP90AB2P L3MBTL1 2152/4885MEN1 4568/4885KMT2A 4029/4885

“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.