SCHEMBL2365475

SCHEMBL2365475

Cc1ccc2nc(C(N)=O)n(CCN3CCOCC3)c2c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
CREBBP Q92793 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 2/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CNR2 P34972 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
EPHX2 P34913 1/20 0.43
GAA P10253 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
SCHEMBL2362286 0.82 TLR8 (0.60) LMNAMAPTTSHRCREBBPHSD17B10
SCHEMBL18731439 0.76 LMNA (0.61) LMNAMAPTTSHRCREBBPSMN1; SMN2
SCHEMBL2853106 0.74 ACSS2 (0.43) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL23638275 0.72 RAB9A (0.58) LMNAMAPTTSHRCREBBPSMN1; SMN2
SCHEMBL18731438 0.71 LMNA (0.53) LMNAMAPTTSHRCREBBPMEN1
SCHEMBL6414028 0.70 JAK2 (0.47) MAPTSMN1; SMN2HSD17B10CASP1MEN1
SCHEMBL17678061 0.69 LMNA (0.66) LMNAMAPTTSHRCREBBPHTT
SCHEMBL17678352 0.69 ALDH1A1 (0.51) LMNAMAPTTSHRCREBBPSMN1; SMN2
SCHEMBL3839667 0.68 KMT2A (0.42) LMNATSHRSMN1; SMN2HSD17B10MEN1
SCHEMBL21026154 0.68 LMNA (0.63) LMNAMAPTTSHRCREBBPHSD17B10

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
WO-2011099832-A2 NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CRYSTALGENOMICS, INC. (KR) 2011-08-18 WO disclosed