SCHEMBL5391086

SCHEMBL5391086

Cc1ccc(C(=O)Nc2ccc(Nc3nc(NCCCn4ccnc4)nc(N4C[C@H](N)C[C@H](N)C4)n3)cc2O)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 5/20 0.40
▸ HTT P42858 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 3/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ QPCT Q16769 1/20 0.37
▸ GBA1 P04062 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ RAD52 P43351 1/20 0.36
▸ TDP1 Q9NUW8 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
SCHEMBL5445977 0.93 SMN1; SMN2 (0.42) NAMPTHTTKDM4ELMNASMN1; SMN2
SCHEMBL14503615 0.89 GBA1 (0.48) NAMPTHTTKDM4ELMNAMAPK1
SCHEMBL5380923 0.84 MAPT (0.41) HTTKDM4ELMNASMN1; SMN2MEN1
SCHEMBL5391464 0.83 MAPT (0.40) HTTKDM4ELMNASMN1; SMN2MEN1
SCHEMBL14503569 0.83 MAPT (0.40) HTTKDM4ELMNASMN1; SMN2MEN1
SCHEMBL5391472 0.83 RAB9A (0.43) KDM4ELMNAKMT2AGBA1GAA
SCHEMBL14428629 0.82 MAPT (0.39) HTTKDM4ELMNASMN1; SMN2MEN1
SCHEMBL14503562 0.81 GBA1 (0.48) NAMPTHTTLMNAMAPK1SMN1; SMN2
SCHEMBL5384918 0.81 MAPT (0.38) HTTKDM4ELMNASMN1; SMN2MEN1
SCHEMBL14428604 0.81 CAMK1D (0.39) HTTKDM4ELMNASMN1; SMN2MEN1

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-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 — — US disclosed
US-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 — — US disclosed
US-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 — — US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 — — US disclosed
US-20050239827-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compouds ANADYS PHARMACEUTICALS, INC. 2005-10-27 — — 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-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds DDC, DPP3, AMPD3 NAMPT 1271/4885HTT 949/4885KDM4E 2224/4885
US-20050239827-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compouds AMPD3, AAAS, PEPD NAMPT 1473/4885HTT 516/4885KDM4E 2873/4885

“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.

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