SCHEMBL11065342

SCHEMBL11065342

O=C1CN(c2ccccc2)C(=S)N1c1ccc(Cl)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
KMT2A Q03164 7/20 0.48
MEN1 O00255 6/20 0.48
CTSG P08311 1/20 0.48
CMA1 P23946 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MGLL Q99685 1/20 0.42

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
SCHEMBL1685398 0.90 KMT2A (0.56) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL5955265 0.89 MEN1 (0.54) HTTKMT2AMEN1CTSGCMA1
SCHEMBL11072116 0.84 KMT2A (0.49) HTTKMT2AMEN1CTSGCMA1
SCHEMBL9724603 0.83 OPRK1 (0.52) HTTKMT2AMEN1GAACYP3A4
SCHEMBL5955129 0.81 PLCG1 (0.55) KMT2AMEN1CTSGCMA1NPC1
SCHEMBL5955275 0.81 KMT2A (0.56) KMT2AMEN1CTSGNPC1RAB9A
SCHEMBL5955047 0.81 KMT2A (0.56) KMT2AMEN1CTSGNPC1RAB9A
SCHEMBL11638136 0.81 NPC1 (0.56) KMT2AMEN1CTSGCMA1NPC1
SCHEMBL11071726 0.80 CTSG (0.51) KMT2AMEN1CTSGCMA1NPC1
SCHEMBL11147745 0.79 DUSP22 (0.47) KMT2AMEN1CTSGCMA1NPC1

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-4473393-A INSECTICIDES, MITICIDES, NEMATOCIDES, FUNGICIDES, AND HERBICIDE BUFFALO COLOR CORPORATION (US) 1984-09-25 US disclosed