SCHEMBL4151598

SCHEMBL4151598

O=C(c1cc(-c2ccc(F)cc2F)ccc1O)N1Cc2ccccc2C1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRAP1 Q12931 9/20 0.63
HSP90B1 P14625 6/20 0.63
ACMSD Q8TDX5 2/20 0.60
KDM4E B2RXH2 1/20 0.60
MEN1 O00255 1/20 0.60
USP2 O75604 1/20 0.60
ALDH1A1 P00352 1/20 0.60
DHFR P00374 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
LMNA P02545 1/20 0.60
TTR P02766 1/20 0.60
ALB P02768 1/20 0.60
HMGB1 P09429 1/20 0.60
HPGD P15428 1/20 0.60
CXCL12 P48061 1/20 0.60
KMT2A Q03164 1/20 0.60
HIF1A Q16665 1/20 0.60
SLC22A6 Q4U2R8 1/20 0.60
HSD17B10 Q99714 1/20 0.60

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
SCHEMBL4155944 0.86 TRAP1 (0.78) TRAP1HSP90B1HSP90AA1HSP90AB1
SCHEMBL4158772 0.79 TRAP1 (0.68) TRAP1HSP90B1ACMSDDHFRHSP90AA1
SCHEMBL4165290 0.78 HSP90AA1 (0.59) TRAP1HSP90B1HSP90AA1HSP90AB1
SCHEMBL27153437 0.78 TRAP1 (1.00) TRAP1HSP90B1HSP90AA1HSP90AB1
SCHEMBL27144871 0.78 TRAP1 (1.00) TRAP1HSP90B1HSP90AA1HSP90AB1
SCHEMBL4156177 0.77 HSP90AA1 (0.72) TRAP1HSP90B1HSP90AA1HSP90AB1
Diflunisal SCHEMBL4337 0.76 ACMSD (1.00) ACMSDKDM4EMEN1USP2ALDH1A1
Diflunisal SCHEMBL30509654 0.76 ACMSD (1.00) ACMSDKDM4EMEN1USP2ALDH1A1
Diflunisal SCHEMBL29367380 0.76 ACMSD (1.00) ACMSDKDM4EMEN1USP2ALDH1A1
Diflunisal SCHEMBL3848363 0.76 ACMSD (1.00) ACMSDKDM4EMEN1USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US claimed
EP-1879863-A1 AMIDE RESORCINOL COMPOUNDS Pfizer, Inc. (US) 2008-01-23 EP claimed
WO-2006117669-A1 AMIDE RESORCINOL COMPOUNDS PFIZER INC. (US) 2006-11-09 WO claimed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
EP-1879863-A1 AMIDE RESORCINOL COMPOUNDS Pfizer, Inc. (US) 2008-01-23 EP disclosed
WO-2006117669-A1 AMIDE RESORCINOL COMPOUNDS PFIZER INC. (US) 2006-11-09 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-20090215742-A1 AMIDE RESORCINOL COMPOUNDS HSP90AB1, HSP90AA1, HSP90AB2P TRAP1 26/4885HSP90B1 4/4885ACMSD 2642/4885

“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.