SCHEMBL268992

SCHEMBL268992

Cc1cccc(C=NNC(=O)c2cc(Br)ccc2NC(=O)c2ccccn2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 12/20 0.54
GAA P10253 6/20 0.54
MAPT P10636 3/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
HPGD P15428 1/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
OPRK1 P41145 2/20 0.51
MGAM O43451 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
BACE1 P56817 1/20 0.48
PKM P14618 3/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL274137 1.00 RAB9A (0.57) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL267031 0.91 NPC1 (0.55) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL273957 0.91 NPC1 (0.55) RAB9ASMN1; SMN2NPC1GAAMAPT
Hydrochloric Acid SCHEMBL265826 0.90 NPC1 (0.54) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL266553 0.89 NPC1 (0.53) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL273716 0.89 NPC1 (0.53) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL268120 0.88 MEN1 (0.51) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL273686 0.88 MEN1 (0.51) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL269535 0.88 MEN1 (0.51) RAB9ASMN1; SMN2NPC1GAAMAPT
SCHEMBL274295 0.88 MEN1 (0.51) RAB9ASMN1; SMN2NPC1GAAMAPT

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-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed