SCHEMBL268775

SCHEMBL268775

Cc1ccc(C=NNC(=O)c2cc(Br)ccc2NC(=O)c2cccs2)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.54
RAB9A P51151 12/20 0.54
NPC1 O15118 11/20 0.54
SMN1; SMN2 Q16637 6/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
CYP1A2 P05177 3/20 0.54
CYP2C9 P11712 3/20 0.54
CYP2C19 P33261 3/20 0.54
CYP2D6 P10635 2/20 0.54
POLB P06746 5/20 0.49
PKM P14618 2/20 0.49
GAA P10253 3/20 0.48
GFER P55789 1/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KDM4E B2RXH2 3/20 0.47
HTT P42858 1/20 0.47
CYP3A4 P08684 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 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
SCHEMBL273641 1.00 MAPT (0.54) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL266744 0.90 POLB (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL273288 0.90 POLB (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL273634 0.89 RAB9A (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL266263 0.89 RAB9A (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL273287 0.86 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL269023 0.86 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL267036 0.85 POLB (0.54) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL273459 0.85 POLB (0.54) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL266460 0.83 POLB (0.46) MAPTRAB9ANPC1SMN1; SMN2MEN1

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