SCHEMBL11236633

SCHEMBL11236633

O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(SCc2ccc(Cl)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.51
▸ SIRT2 Q8IXJ6 2/20 0.47
▸ MEN1 O00255 8/20 0.47
▸ KMT2A Q03164 8/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ RAB9A P51151 3/20 0.46
▸ HPGD P15428 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ PKM P14618 1/20 0.45
▸ ITGB1 P05556 1/20 0.44
▸ ITGA4 P13612 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CNR1 P21554 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ GAA P10253 1/20 0.43

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
SCHEMBL11238363 0.88 NPC1 (0.54) MAPTSIRT2MEN1KMT2ASMN1; SMN2
Diflubenzuron SCHEMBL18837607 0.85 RAB9A (0.59) MAPTMEN1KMT2ARAB9ANPC1
Diflubenzuron SCHEMBL42416 0.85 RAB9A (0.59) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL9324631 0.83 RAB9A (0.57) MAPTMEN1KMT2ARAB9ANPC1
Diflubenzuron SCHEMBL8729691 0.81 NPC1 (0.56) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL10711203 0.81 RAB9A (0.56) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL11242722 0.81 GCGR (0.54) MAPTSIRT2MEN1KMT2ASMN1; SMN2
Diflubenzuron SCHEMBL28169066 0.80 NPC1 (0.54) MEN1KMT2ARAB9ANPC1PKM
SCHEMBL11381816 0.80 NPC1 (0.50) MEN1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL11246141 0.79 ATM (0.46) MAPTMEN1KMT2ASMN1; SMN2RAB9A

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
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