SCHEMBL8972229

SCHEMBL8972229

CCCCCN(CO)C(=O)[C@H](CC(C)C)NC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ PLA2G2A P14555 2/20 0.40
▸ PLA2G5 P39877 2/20 0.40
▸ CCKBR P32239 3/20 0.35
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ FURIN P09958 1/20 0.34
▸ PCSK6 P29122 1/20 0.34
▸ BIRC2 Q13490 2/20 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
SCHEMBL9572313 0.76 SLC7A5 (0.40) —
SCHEMBL8972573 0.76 ALDH1A1 (0.42) ALDH1A1PLA2G2APLA2G5SIRT6SIRT1
SCHEMBL8972578 0.76 ALDH1A1 (0.42) ALDH1A1PLA2G2APLA2G5SIRT6SIRT1
SCHEMBL8972026 0.76 CTSK (0.58) CCKBR
SCHEMBL8971858 0.75 ALDH1A1 (0.50) ALDH1A1
Acetylleucine SCHEMBL27864478 0.73 ALDH1A1 (0.79) ALDH1A1PLA2G2APLA2G5SIRT6SIRT1
SCHEMBL1981143 0.71 CCKBR (0.59) CCKBR
SCHEMBL18796618 0.70 FAAH (0.54) PLA2G2APLA2G5
SCHEMBL18796619 0.70 FAAH (0.54) PLA2G2APLA2G5
SCHEMBL7299506 0.69 PSEN1 (0.41) ALDH1A1PLA2G2APLA2G5CCKBRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543310-B1 Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LTD (JP) 1996-03-27 — — EP disclosed
US-5395824-A Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LIMITED (JP) 1995-03-07 — — US disclosed
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