SCHEMBL180415

SCHEMBL180415

NC(Cc1ccc(-c2ccccc2)cc1)C(=O)O.O=C(O)[C@H](Cc1ccccc1)NN[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.67
ALPI P09923 1/20 0.67
PKM P14618 1/20 0.67
PTGS1 P23219 1/20 0.67
XIAP P98170 1/20 0.67
MME P08473 5/20 0.57
ACE2 Q9BYF1 4/20 0.56
ACE P12821 3/20 0.56
CPA1 P15085 3/20 0.56
TPH1 P17752 5/20 0.55
MMP2 P08253 4/20 0.54
MMP9 P14780 3/20 0.54
ADAMTS4 O75173 1/20 0.54
SRR Q9GZT4 1/20 0.51
PSAT1 Q9Y617 1/20 0.51
GRIA2 P42262 1/20 0.51

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
SCHEMBL4960292 0.91 MME (0.67) MMEACE2ACECPA1MMP2
SCHEMBL180272 0.89 SLC7A5 (0.78) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL1796036 0.89 SLC7A5 (0.78) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL93495 0.89 SLC7A5 (0.78) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL414363 0.89 SLC7A5 (0.78) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL93494 0.89 SLC7A5 (0.78) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL7567510 0.87 SLC7A5 (0.75) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL3695982 0.87 SLC7A5 (0.75) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL6888643 0.87 SLC7A5 (0.75) SLC7A5ALPIPKMPTGS1XIAP
D-Phenylalanine SCHEMBL23044028 0.87 SLC7A5 (0.88) SLC7A5ALPIPKMPTGS1XIAP

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
EP-2402364-A2 A nonapeptide with anti-tumour activity Lytix Biopharma AS (NO) 2012-01-04 EP claimed
EP-2402364-A2 A nonapeptide with anti-tumour activity Lytix Biopharma AS (NO) 2012-01-04 EP disclosed
EP-2361258-A1 A NONAPEPTIDE WITH ANTI-TUMOUR ACTIVITY Lytix Biopharma AS (NO) 2011-08-31 EP disclosed