SCHEMBL4905927

SCHEMBL4905927

CC(=O)NCc1cc(F)ccc1Cc1cnc2c(O)c(C(=O)O)c(=O)n(C)c2c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HIF1A Q16665 11/20 0.36
ALDH1A1 P00352 1/20 0.36
P2RX7 Q99572 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MET P08581 2/20 0.33
PLK1 P53350 1/20 0.33

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
SCHEMBL4901060 0.89 KDM4E (0.43) MEN1KMT2AHIF1ANPC1RAB9A
SCHEMBL4576606 0.88 MEN1 (0.37) MEN1KMT2AHIF1AALDH1A1NPC1
SCHEMBL4576040 0.88 KMT2A (0.35) MEN1KMT2AHIF1AP2RX7NPC1
SCHEMBL5545343 0.87 MEN1 (0.36) MEN1KMT2AHIF1AALDH1A1NPC1
SCHEMBL5546795 0.86 TOP2A (0.35) MEN1KMT2AHIF1A
SCHEMBL4591362 0.86 MEN1 (0.34) MEN1KMT2AHIF1AALDH1A1
SCHEMBL4590898 0.86 MEN1 (0.36) MEN1KMT2AHIF1ANPC1RAB9A
SCHEMBL4576778 0.86 TACR1 (0.33) MEN1KMT2AHIF1A
SCHEMBL4590860 0.85 MEN1 (0.34) MEN1KMT2AHIF1AALDH1A1NPC1
SCHEMBL4591622 0.85 HIF1A (0.34) MEN1KMT2AHIF1AALDH1A1

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 1 patent. 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

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 MEN1 4841/4885KMT2A 682/4885HIF1A 3129/4885

“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.