SCHEMBL7911613

SCHEMBL7911613

N=C(N)NCCC[C@H](NC(N)=S)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ C3AR1 Q16581 1/20 0.40
▸ GNPAT O15228 2/20 0.40
▸ FOLH1 Q04609 6/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NOD1 Q9Y239 2/20 0.36
▸ ALOX15 P16050 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ SIRT5 Q9NXA8 1/20 0.34
▸ NPY4R P50391 3/20 0.34
▸ NPY1R P25929 2/20 0.34
▸ NPY2R P49146 2/20 0.34
▸ NPY5R Q15761 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ DDAH1 O94760 1/20 0.34

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
SCHEMBL12971304 0.88 C3AR1 (0.43) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL29005731 0.88 C3AR1 (0.43) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL27864032 0.87 C3AR1 (0.42) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL21095440 0.87 C3AR1 (0.42) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL1765039 0.87 C3AR1 (0.45) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL1765043 0.87 C3AR1 (0.45) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL5490001 0.87 C3AR1 (0.45) C3AR1GNPATFOLH1SMN1; SMN2NOD1
Guanidine SCHEMBL28238974 0.85 C3AR1 (0.41) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL7196910 0.85 GNPAT (0.46) C3AR1GNPATFOLH1SMN1; SMN2NOD1
SCHEMBL408774 0.85 GNPAT (0.46) C3AR1GNPATFOLH1SMN1; SMN2NOD1

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-6329498-B1 AMINO ACID SEQUENCE; STABLE PREPARATION FOR TREATMENT OF HUMAN IMMUNODEFICIENCY VIRUS SEIKAGAKU CORPORATION (JP) 2001-12-11 — — US disclosed
EP-1016672-A1 POLYPEPTIDE TRANSITION METAL SALTS AND METHOD OF ENHANCING ANTI-HIV ACTIVITY OF POLYPEPTIDE SEIKAGAKU CORPORATION (JP) 2000-07-05 — — EP disclosed
CN-1233257-A Polypeptide transition metal salts and method of enhancing anti-HIV activity of polypeptide SEIKAGAKU KOGYO CO LTD (JP) 1999-10-27 — — CN disclosed
EP-0677061-B1 POLYPEPTIDES AND ANTI-HIV AGENTS PREPARED THEREFROM SEIKAGAKU KOGYO CO LTD (JP) 1999-03-03 — — EP disclosed
US-5776899-A Polypeptide and anti-HIV agent prepared therefrom SEIKAGAKU CORPORATION (JP) 1998-07-07 — — US disclosed
CN-1038841-C Polypeptide and anti-hiv agent prepared therefrom SEIKAGAKU CO (JP) 1998-06-24 — — CN disclosed
CN-1116427-A Novel polypeptide and anti-HIV agent prepared from the same SEIKAGAKU KOGYO CO LTD (JP) 1996-02-07 — — CN disclosed
EP-0677061-A1 POLYPEPTIDE AND ANTI-HIV AGENT PREPARED THEREFROM SEIKAGAKU CORPORATION (JP) 1995-10-18 — — EP disclosed
WO-1995010534-A1 POLYPEPTIDE AND ANTI-HIV AGENT PREPARED THEREFROM SEIKAGAKU CORPORATION (JP) 1995-04-20 — — WO disclosed
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