SCHEMBL4713762

SCHEMBL4713762

Cn1c(=O)c(C(=O)NCCCCP(=O)(O)O)c(O)c2ncc(Cc3ccc(F)cc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.43
HIF1A Q16665 9/20 0.42
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL4715876 0.97 MEN1 (0.49) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL4714031 0.95 MEN1 (0.50) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL14072837 0.93 MEN1 (0.44) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL5546508 0.91 MEN1 (0.50) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL5004742 0.91 MEN1 (0.44) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL14072838 0.90 MEN1 (0.44) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL4718024 0.90 MEN1 (0.51) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL5538979 0.89 MEN1 (0.48) MEN1KMT2AL3MBTL1HIF1AKDM4E
Gsk-364735 SCHEMBL5545304 0.89 KDM4E (0.53) MEN1KMT2AL3MBTL1HIF1AKDM4E
SCHEMBL5545906 0.89 MEN1 (0.48) MEN1KMT2AL3MBTL1HIF1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US claimed
EP-1910356-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP claimed
WO-2007019101-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO claimed
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
US-20080214503-A1 Hiv Integrase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
EP-1910356-A2 HIV INTEGRASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-16 EP disclosed
WO-2007019101-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO disclosed
WO-2007019101-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-20080214503-A1 Hiv Integrase Inhibitors SAMHD1, ACIN1, API5 MEN1 4822/4885KMT2A 1762/4885L3MBTL1 1487/4885

“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.