SCHEMBL4591622

SCHEMBL4591622

COCc1cc(F)ccc1Cc1cnc2c(O)c(C(=O)O)c(=O)n(C)c2c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.34
ERCC5 P28715 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
PTGER1 P34995 1/20 0.33
EGLN1 Q9GZT9 1/20 0.32
LMNA P02545 2/20 0.32
FEN1 P39748 3/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL4591225 0.90 KDM5A (0.34) MEN1KMT2APTGER1GAAMAPT
SCHEMBL5546555 0.90 HDAC3 (0.38) HIF1AERCC5MEN1KMT2AEGLN1
SCHEMBL4576606 0.90 MEN1 (0.37) HIF1AMEN1KMT2AFEN1ALDH1A1
SCHEMBL5545343 0.88 MEN1 (0.36) HIF1AMEN1KMT2ALMNAFEN1
SCHEMBL4591362 0.88 MEN1 (0.34) HIF1AMEN1KMT2AALDH1A1MAPT
SCHEMBL4906700 0.87 KDM4E (0.43) HIF1AMEN1KMT2AEGLN1
SCHEMBL14067487 0.87 MEN1 (0.39) HIF1AMEN1KMT2AEGLN1HTT
SCHEMBL5548083 0.86 MEN1 (0.35) HIF1AERCC5MEN1KMT2ALMNA
SCHEMBL4905927 0.85 MEN1 (0.38) HIF1AMEN1KMT2AALDH1A1
SCHEMBL4576192 0.85 GRIN2B (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214527-A1 Hiv Integrase Inhibitors SHIONOGI & CO. LTD (JP) 2008-09-04 US claimed
EP-1910363-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP claimed
WO-2007019098-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO claimed
EP-1910363-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP disclosed
WO-2007019098-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 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-20080214527-A1 Hiv Integrase Inhibitors API5, ING2, SAMHD1 HIF1A 3129/4885ERCC5 912/4885MEN1 4841/4885

“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.