SCHEMBL9560535

SCHEMBL9560535

CCc1ccc(NC2=C(Cl)C(=O)C(Nc3ccc(CC)cc3)=C(Cl)C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.49
MAPT P10636 7/20 0.49
HTT P42858 7/20 0.49
NPC1 O15118 7/20 0.49
NPSR1 Q6W5P4 6/20 0.49
KMT2A Q03164 5/20 0.49
MAPK1 P28482 5/20 0.49
MEN1 O00255 4/20 0.49
ALDH1A1 P00352 4/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
TDP1 Q9NUW8 3/20 0.49
ATM Q13315 3/20 0.49
HPGD P15428 3/20 0.49
KDM4E B2RXH2 1/20 0.49
THRB P10828 1/20 0.49
MCL1 Q07820 1/20 0.49
MITF O75030 3/20 0.49
APAF1 O14727 1/20 0.47
GAA P10253 4/20 0.46
LMNA P02545 3/20 0.46

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
SCHEMBL49571 0.76 RAB9A (0.55) RAB9AMAPTNPC1KMT2AMAPK1
SCHEMBL13417403 0.74 MAPT (0.50) RAB9AMAPTHTTNPC1NPSR1
SCHEMBL20074137 0.73 RAB9A (0.53) RAB9AMAPTHTTNPC1NPSR1
SCHEMBL22819595 0.73 RAB9A (0.46) RAB9AMAPTHTTNPC1KMT2A
SCHEMBL13962358 0.73 P2RY4 (0.48) RAB9AMAPTHTTNPC1NPSR1
SCHEMBL20074052 0.73 MAPT (0.59) RAB9AMAPTHTTNPC1NPSR1
SCHEMBL13769425 0.70 UCHL1 (0.55) RAB9AMAPTNPC1KMT2AMAPK1
SCHEMBL9418580 0.70 RAB9A (0.50) RAB9AMAPTHTTNPC1KMT2A
SCHEMBL13868993 0.69 RAB9A (0.76) RAB9AMAPTHTTNPC1NPSR1
SCHEMBL2749762 0.69 ALDH1A1 (0.62) RAB9AMAPTHTTNPC1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552223-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS. NOVO NORDISK AS (DK) 1993-07-28 EP disclosed
WO-1992007263-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS NOVO NORDISK A/S (DK) 1992-04-30 WO disclosed