SCHEMBL8553318

SCHEMBL8553318

Cc1sc2ccc(NC(=O)c3cccs3)cc2c1CCNCc1noc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
SENP5 Q96HI0 9/20 0.43
SENP2 Q9HC62 9/20 0.43
SENP1 Q9P0U3 9/20 0.43
KMT2A Q03164 5/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 3/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
ALOX12 P18054 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HIF1A Q16665 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
GAPDH P04406 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL8552326 0.86 KMT2A (0.45) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL7145588 0.85 MAPT (0.42) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL8550888 0.72 KMT2A (0.44) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL7136637 0.71 HTR1F (0.46) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL8552317 0.64 RAB9A (0.36) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL24479782 0.64 MAPT (0.71) MAPTNPC1RAB9AHPGDNPSR1
SCHEMBL8552436 0.62 KMT2A (0.49) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL24479619 0.61 MAPT (1.00) MAPTKMT2ANPC1RAB9AHPGD
SCHEMBL24479555 0.59 MAPT (0.70) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL12495837 0.59 NPC1 (1.00) MAPTKMT2ANPC1RAB9AMEN1

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
EP-0835869-A2 New serotonin 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed