SCHEMBL14447474

SCHEMBL14447474

Cc1cc2nc(C3CCN(C(=O)OC(C)(C)C)CC3)[nH]c2cc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
TP53 P04637 2/20 0.56
LMNA P02545 1/20 0.56
PKM P14618 1/20 0.52
KDM4E B2RXH2 3/20 0.50
THRB P10828 1/20 0.50
POLB P06746 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HPGDS O60760 1/20 0.47
CHEK2 O96017 1/20 0.45
USP2 O75604 2/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL14447473 0.88 MAPT (0.49) MAPTHTTTP53LMNAKDM4E
SCHEMBL17109171 0.87 USP2 (0.49) MAPTHTTTP53LMNAKDM4E
SCHEMBL12026565 0.84 HTR2B (0.49) MAPTHTTKDM4ETHRBSMN1; SMN2
SCHEMBL12026566 0.84 MAPT (0.47) MAPTHTTTP53LMNAKDM4E
SCHEMBL1299150 0.84 SMN1; SMN2 (0.52) MAPTHTTTP53LMNAKDM4E
SCHEMBL14447475 0.83 LMNA (0.60) MAPTHTTTP53LMNAPKM
SCHEMBL992227 0.83 HTR2B (0.59) MAPTPKMPOLBSMN1; SMN2HPGDS
SCHEMBL17115816 0.83 HPGDS (0.51) MAPTKDM4ETHRBSMN1; SMN2KMT2A
SCHEMBL12026706 0.82 MAPT (0.46) MAPTHTTTP53LMNAKDM4E
SCHEMBL2595515 0.81 GPR119 (0.54) MAPTKDM4ETHRBHPGDS

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
US-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 US disclosed