SCHEMBL27273950

SCHEMBL27273950

NC(Cc1c[nH]cn1)C(=O)NC(=O)[C@@H]1CCCN1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 4/20 0.37
▸ SCN3A Q9NY46 2/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ REN P00797 2/20 0.35
▸ HTR2C P28335 4/20 0.34
▸ HTR2B P41595 2/20 0.34
▸ TERT O14746 1/20 0.34
▸ WNT1 P04628 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ PRCP P42785 1/20 0.33
▸ DPP7 Q9UHL4 1/20 0.33
▸ CTSK P43235 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32

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
Histidine SCHEMBL2586200 0.81 SLC7A5 (0.35) CTSCSCN3ASCN9AHTR2CHTR2B
Histidine SCHEMBL27902238 0.81 SLC7A5 (0.35) CTSCSCN3ASCN9AHTR2CHTR2B
Histidine SCHEMBL2586203 0.81 SLC7A5 (0.35) CTSCSCN3ASCN9AHTR2CHTR2B
D-Histidine SCHEMBL11606906 0.81 SLC7A5 (0.35) CTSCSCN3ASCN9AHTR2CHTR2B
Histidine SCHEMBL10455821 0.81 SLC7A5 (0.34) CTSCHTR2CHTR2B
Histidine SCHEMBL9719668 0.81 SLC7A5 (0.34) CTSCHTR2CHTR2B
Histidine SCHEMBL3490081 0.80 CYP3A4 (0.32) CTSC
Histidine SCHEMBL790243 0.80 CYP3A4 (0.32) CTSC
Histidine SCHEMBL1675273 0.80 CYP3A4 (0.32) CTSC
Histidine SCHEMBL3088582 0.80 CYP3A4 (0.32) CTSC

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
CN-1020457-C Process for preparing novel derivatives of 1-methyl-4, 5-dihydroorotic acid and pharmaceutical compositions thereof TANABE SEIYAKU CO (JP) 1993-05-05 — — CN claimed
CN-85105655-A Process for preparing novel derivatives of 1-methyl-4, 5-dihydroorotic acid and pharmaceutical compositions thereof — 1987-01-28 — — CN claimed
CN-105949280-A Preparation method of Taltirelin and intermediate thereof 吉尔生化(上海)有限公司 2016-09-21 — — CN disclosed
CN-103665170-A Peptide therapeutic conjugates and uses thereof ANGIOCHEM INC 2014-03-26 — — CN disclosed
CN-102348723-A Peptide therapeutic agent conjugates and uses thereof ANGIOCHEM INC 2012-02-08 — — CN disclosed
CN-1214040-C Peptide derivatives having thiazolyl-alanine residues SHIONOGI & CO (JP) 2005-08-10 — — CN disclosed
CN-1235610-A Peptide derivatives having thiazolyl-alanine residues SHIONOGI & CO (JP) 1999-11-17 — — CN disclosed
CN-1020457-C Process for preparing novel derivatives of 1-methyl-4, 5-dihydroorotic acid and pharmaceutical compositions thereof TANABE SEIYAKU CO (JP) 1993-05-05 — — CN disclosed
CN-85105655-A Process for preparing novel derivatives of 1-methyl-4, 5-dihydroorotic acid and pharmaceutical compositions thereof — 1987-01-28 — — CN disclosed
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