SCHEMBL5763516

SCHEMBL5763516

C[C@H](N)C(=O)N[C@@H]1C(=O)NC[C@@H](c2ccccc2)C[C@@H]1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NAAA Q02083 1/20 0.36
FPR2 P25090 6/20 0.36
FPR1 P21462 5/20 0.36
XIAP P98170 2/20 0.36
CTSL P07711 1/20 0.35
F2RL1 P55085 2/20 0.35

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
SCHEMBL5761078 1.00 KDM1A (0.39) KDM1ASMN1; SMN2NPSR1NAAAFPR2
SCHEMBL5763400 1.00 KDM1A (0.39) KDM1ASMN1; SMN2NPSR1NAAAFPR2
SCHEMBL5763512 0.81 KDM1A (0.56) KDM1AF2RL1
SCHEMBL5763397 0.81 KDM1A (0.56) KDM1AF2RL1
SCHEMBL5761075 0.81 KDM1A (0.56) KDM1AF2RL1
SCHEMBL5762788 0.80 ALDH1A1 (0.41) KDM1AFPR2FPR1XIAP
SCHEMBL5763042 0.80 ALDH1A1 (0.41) KDM1AFPR2FPR1XIAP
SCHEMBL5763995 0.80 NAAA (0.46) NAAAXIAPCTSL
SCHEMBL5764623 0.80 NAAA (0.46) NAAAXIAPCTSL
SCHEMBL5792641 0.78 XIAP (0.44) KDM1ASMN1; SMN2NPSR1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636196-A1 NOVEL LACTAMS AND USES THEREOF AstraZeneca AB (SE) 2006-03-22 EP claimed
WO-2004080983-A1 NOVEL LACTAMS AND USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 WO claimed
EP-1636196-A1 NOVEL LACTAMS AND USES THEREOF AstraZeneca AB (SE) 2006-03-22 EP disclosed
WO-2004080983-A1 NOVEL LACTAMS AND USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 WO disclosed