SCHEMBL6065771

SCHEMBL6065771

[CH2]C([CH2])NC(=O)CC(=O)Nc1c(C)n[nH]c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP2C19 P33261 1/20 0.34
ADORA3 P0DMS8 7/20 0.33
ADORA2A P29274 7/20 0.33
GAA P10253 2/20 0.32
ADORA1 P30542 4/20 0.32
RET P07949 1/20 0.32
KDR P35968 1/20 0.32
TSHR P16473 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FTO Q9C0B1 1/20 0.30
RIPK1 Q13546 1/20 0.30

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
SCHEMBL6065131 0.86 LMNA (0.40) LMNAL3MBTL1CYP2C19ADORA3ADORA2A
SCHEMBL6065097 0.82 PKM (0.45) LMNAL3MBTL1CYP2C19ADORA3ADORA2A
SCHEMBL6066190 0.79 SMN1; SMN2 (0.35) LMNAL3MBTL1CYP2C19ADORA3ADORA2A
SCHEMBL6065740 0.75 F2 (0.41) LMNACYP2C19GAATP53ALDH1A1
SCHEMBL6558343 0.69 NPC1 (0.41) LMNAGAATP53ALDH1A1
SCHEMBL6065290 0.66 DUT (0.30)
SCHEMBL6065016 0.66 KMT2A (0.33) LMNASMN1; SMN2FTO
SCHEMBL6557067 0.66 P2RX3 (0.35) LMNAL3MBTL1GAAPOLBALDH1A1
SCHEMBL6557418 0.65 HSD17B10 (0.36) LMNACYP2C19GAATSHRPOLB
SCHEMBL6558372 0.65 POLB (0.43) LMNATSHRTP53POLBALDH1A1

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-1663245-A1 CEPHEM COMPOUNDS Astellas Pharma Inc. (JP) 2006-06-07 EP disclosed
WO-2005027909-A1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC. (JP) 2005-03-31 WO disclosed