SCHEMBL14667384

SCHEMBL14667384

COCCCSCC(=O)Nc1cc(C(=O)O)ccc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 2/20 0.48
▸ LNPEP Q9UIQ6 5/20 0.41
▸ ERAP2 Q6P179 2/20 0.41
▸ HDAC1 Q13547 4/20 0.40
▸ HDAC3 O15379 2/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ PLEC Q15149 1/20 0.39
▸ LTB4R Q15722 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38

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
SCHEMBL15942845 0.89 HDAC1 (0.42) PTGER4LNPEPERAP2HDAC1HDAC3
SCHEMBL14667441 0.86 HSD17B10 (0.47) HDAC1HDAC3ALDH1A1KDM4EMAPT
SCHEMBL15942868 0.85 KMT2A (0.46) HDAC1HDAC3MEN1KMT2AALDH1A1
SCHEMBL15942847 0.85 LNPEP (0.45) LNPEPERAP2
SCHEMBL15942856 0.83 ERAP2 (0.48) LNPEPERAP2
SCHEMBL14668915 0.82 ERAP2 (0.47) LNPEPERAP2ALDH1A1LMNA
SCHEMBL14667412 0.82 LNPEP (0.47) LNPEPERAP2
SCHEMBL14667535 0.82 LNPEP (0.37) PTGER4LNPEPERAP2HDAC1HDAC3
SCHEMBL14667392 0.82 HDAC3 (0.51) HDAC1HDAC3ALDH1A1MAPTHPGD
SCHEMBL27378870 0.81 KDM4E (0.48) PTGER4LNPEPERAP2HDAC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8802448-B2 Mixed mode ligands PALL CORPORATION (US) 2014-08-12 — — US disclosed
US-8802448-B2 Mixed mode ligands PALL CORPORATION (US) 2014-08-12 — — US disclosed
US-20130030154-A1 MIXED MODE LIGANDS PALL CORPORATION (US) 2013-01-31 — — 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 (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-20130030154-A1 MIXED MODE LIGANDS NCL, NECTIN4, NCLN PTGER4 3883/4885LNPEP 1080/4885ERAP2 4669/4885

“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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