SCHEMBL27902885

SCHEMBL27902885

Brc1cc(Br)cc(Cc2nc3ccccc3[nH]2)c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.68
GRIN1 Q05586 1/20 0.56
GRIN2B Q13224 1/20 0.56
POLB P06746 2/20 0.56
DDAH1 O94760 1/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KRAS P01116 1/20 0.52
KMT2A Q03164 1/20 0.52
PKM P14618 2/20 0.51
LMNA P02545 2/20 0.51
TSHR P16473 1/20 0.51
EGFR P00533 1/20 0.51
ERBB2 P04626 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
HKDC1 Q2TB90 1/20 0.51
CFB P00751 1/20 0.51

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
SCHEMBL29822827 0.85 GAA (0.75) GAAGRIN1GRIN2BPOLBDDAH1
SCHEMBL483337 0.85 GAA (0.75) GAAGRIN1GRIN2BPOLBDDAH1
SCHEMBL27902886 0.84 GAA (0.68) GAAGRIN1GRIN2BPOLBDDAH1
Bendazol SCHEMBL29539948 0.81 GAA (1.00) GAAGRIN1GRIN2BPOLBDDAH1
Bendazol SCHEMBL309393 0.81 GAA (1.00) GAAGRIN1GRIN2BPOLBDDAH1
SCHEMBL27902884 0.81 GAA (0.68) GAAGRIN1GRIN2BPOLBDDAH1
SCHEMBL230024 0.80 GAA (0.78) GAAGRIN1GRIN2BPOLBDDAH1
Bendazol SCHEMBL27823120 0.80 GAA (0.96) GAAGRIN1GRIN2BPOLBDDAH1
Bendazol SCHEMBL15015931 0.80 GAA (0.96) GAAGRIN1GRIN2BPOLBDDAH1
SCHEMBL2678741 0.77 SMN1; SMN2 (0.69) GAAGRIN1GRIN2BPOLBDDAH1

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
CN-103058931-B Four 2-(3', 5'-dihalo-benzyl) benzimidazole type novel compounds and preparation method thereof GUANGDONG TONESET SCIENCE & TECHNOLOGY CO LTD 2015-07-01 CN disclosed
CN-103058931-A Four 2-(3', 5'-dihalo-benzyl) benzimidazole type novel compounds and preparation method thereof GUANGDONG TONESET SCIENCE & TECHNOLOGY CO LTD 2013-04-24 CN disclosed