SCHEMBL3926026

SCHEMBL3926026

NC(=O)[CH]Cc1ccc(Br)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.39
▸ HTT P42858 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ PYCR1 P32322 1/20 0.38
▸ NPC1 O15118 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MGAM O43451 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SI P14410 1/20 0.35
▸ MGAM2 Q2M2H8 1/20 0.35
▸ DGAT1 O75907 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ RECQL P46063 1/20 0.35

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
SCHEMBL3914151 0.83 IDO1 (0.51) ALDH1A1HTTTP53IDO1MAPK1
SCHEMBL3925390 0.78 ERCC5 (0.42) ALDH1A1HTTDGAT1IDO1MAPT
SCHEMBL2951923 0.77 PYCR1 (0.41) ALDH1A1HTTLMNAPYCR1SMN1; SMN2
SCHEMBL480186 0.77 PYCR1 (0.42) ALDH1A1HTTLMNAPYCR1NPC1
SCHEMBL8173928 0.73 LMNA (0.43) ALDH1A1HTTLMNAPYCR1NPC1
SCHEMBL16827451 0.72 PYCR1 (0.43) ALDH1A1HTTLMNAPYCR1HPGD
SCHEMBL29899638 0.72 GRIK1 (0.46) PYCR1MGAMGAASIMGAM2
SCHEMBL473923 0.72 GRIK1 (0.46) PYCR1MGAMGAASIMGAM2
SCHEMBL1328959 0.71 DGAT1 (0.60) ALDH1A1SMN1; SMN2TSHRKMT2ADGAT1
SCHEMBL27849373 0.70 PYCR1 (0.41) ALDH1A1HTTLMNAPYCR1TSHR

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-2035374-A1 N- (L-ALKYL-2- PHENYLETHYL) -CARBOXAMIDE DERIVATIVES AND USE THEREOF AS FUNGICIDES Syngeta Participations AG (CH) 2009-03-18 — — EP disclosed
WO-2007141009-A1 N- (L-ALKYL-2- PHENYLETHYL) -CARBOXAMIDE DERIVATIVES AND USE THEREOF AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2007-12-13 — — WO disclosed
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