SCHEMBL5548705

SCHEMBL5548705

Cn1c(=O)c(C(=O)O)c(O)c2ncc(Cc3ccc(F)cc3NS(C)(=O)=O)cc21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ERCC5 P28715 1/20 0.33
HIF1A Q16665 7/20 0.33
METAP2 P50579 5/20 0.32
NR3C1 P04150 1/20 0.31
TP53 P04637 2/20 0.31
POLB P06746 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
SCHEMBL5546795 0.88 TOP2A (0.35) FEN1MEN1KMT2AHIF1ATP53
SCHEMBL4576040 0.87 KMT2A (0.35) MEN1KMT2AHIF1A
SCHEMBL5545343 0.86 MEN1 (0.36) FEN1MEN1KMT2AHIF1A
SCHEMBL5547003 0.84 BRD4 (0.35) MEN1KMT2AHIF1AMETAP2TP53
SCHEMBL4590898 0.84 MEN1 (0.36) MEN1KMT2AHIF1A
SCHEMBL4590901 0.83 MEN1 (0.32) MEN1KMT2AHIF1A
SCHEMBL4576606 0.83 MEN1 (0.37) FEN1MEN1KMT2AHIF1A
SCHEMBL5548083 0.83 MEN1 (0.35) FEN1MEN1KMT2AERCC5HIF1A
SCHEMBL4591644 0.83 MEN1 (0.39) MEN1KMT2AHIF1A
SCHEMBL4591394 0.83 MEN1 (0.31) MEN1KMT2AHIF1A

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-20150225399-A1 HIV INTEGRASE INHIBITORS VIIV HEALTHCARE CO (US) 2015-08-13 US disclosed
US-20140256713-A1 2-OXONAPHTHYRIDINE-3-CARBOXAMIDES HIV INTEGRASE INHIBITORS SHIONOGI & CO., LTD. (JP) 2014-09-11 US disclosed
EP-1720856-B1 HIV INTEGRASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-08-14 EP disclosed
CN-1976915-A HIV integrase inhibitors SMITHKLINE BEECHAM CORP (US) 2007-06-06 CN disclosed
US-20070124152-A1 Hiv Integrase Inhibitors GLAXOSMITHKLINE LLC 2007-05-31 US 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 (2 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-20140256713-A1 2-OXONAPHTHYRIDINE-3-CARBOXAMIDES HIV INTEGRASE INHIBITORS BCDIN3D, DUT, SAMHD1 FEN1 821/4885MEN1 4802/4885KMT2A 502/4885
US-20150225399-A1 HIV INTEGRASE INHIBITORS ING2, API5, SAMHD1 FEN1 436/4885MEN1 4837/4885KMT2A 819/4885

“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.