SCHEMBL23657286

SCHEMBL23657286

COCCCn1cnc(Cl)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
NPSR1 Q6W5P4 2/20 0.53
PKM P14618 1/20 0.39
HSD17B10 Q99714 5/20 0.39
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 2/20 0.39
GLA P06280 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 2/20 0.37
CTSL P07711 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL1912821 0.89 MAPT (0.66) MAPTNPSR1PKMALDH1A1GAA
SCHEMBL25497888 0.83 MAPT (0.51) MAPTNPSR1PKMHSD17B10ALDH1A1
SCHEMBL25493045 0.81 MAPT (0.50) MAPTNPSR1PKMHSD17B10ALDH1A1
SCHEMBL9324883 0.77 MAPT (0.51) MAPTNPSR1PKMKMT2AMEN1
SCHEMBL15722731 0.76 MAPT (0.47) MAPTNPSR1PKMALDH1A1NPC1
SCHEMBL15722788 0.76 MAPT (0.47) MAPTNPSR1PKMALDH1A1NPC1
SCHEMBL15722787 0.76 MAPT (0.47) MAPTNPSR1PKMALDH1A1NPC1
SCHEMBL15722749 0.76 MAPT (0.47) MAPTNPSR1PKMALDH1A1NPC1
SCHEMBL13202774 0.75 MAPT (0.46) MAPTNPSR1PKMSMN1; SMN2KMT2A
SCHEMBL23657200 0.73 MEN1 (0.42) MAPTNPSR1HSD17B10ALDH1A1KDM4E

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
WO-2021145729-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-07-22 WO disclosed