SCHEMBL18862330

SCHEMBL18862330

CC(C)CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 14/20 0.55
▸ SLC15A2 Q16348 1/20 0.49
▸ ERAP2 Q6P179 1/20 0.47
▸ ERAP1 Q9NZ08 1/20 0.47
▸ LNPEP Q9UIQ6 1/20 0.47
▸ HRH1 P35367 2/20 0.45
▸ CTSD P07339 1/20 0.42
▸ SLC6A5 Q9Y345 1/20 0.42

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
SCHEMBL22722176 0.95 REN (0.58) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL18857604 0.86 SLC6A5 (0.50) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL18862465 0.86 SLC15A2 (0.53) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL18862366 0.85 GHSR (0.60) REN
SCHEMBL27624890 0.85 SLC15A2 (0.61) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL19051548 0.84 REN (0.57) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL19051549 0.83 SLC15A2 (0.56) RENSLC15A2HRH1SLC6A5
SCHEMBL18862360 0.82 REN (0.52) RENSLC15A2ERAP2ERAP1LNPEP
SCHEMBL18862464 0.82 GHSR (0.62) REN
SCHEMBL18862042 0.81 REN (0.56) RENSLC15A2ERAP2ERAP1LNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170137801-A1 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-05-18 — — US disclosed
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