SCHEMBL7969202

SCHEMBL7969202

CC(C)(C)c1ccc([CH]c2cccc(Cl)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 8/20 0.38
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP1A2 P05177 1/20 0.35
AMY1A P0DUB6 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 4/20 0.33
NPC1 O15118 3/20 0.33
LMNA P02545 3/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRIN2D O15399 2/20 0.33
GRIN3B O60391 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
GRIN3A Q8TCU5 2/20 0.33

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
SCHEMBL7971708 0.83 AHR (0.41) NFE2L2TSHRCYP3A4CYP1A2LMNA
SCHEMBL7958651 0.77 NFE2L2 (0.56) NFE2L2TSHRCYP3A4CYP1A2RAB9A
SCHEMBL7969643 0.75 NFE2L2 (0.38) NFE2L2TSHRCYP3A4RAB9ANPC1
SCHEMBL7971487 0.73 MAOB (0.35) NFE2L2TSHRLMNAKMT2AGAA
SCHEMBL7971462 0.72 NFE2L2 (0.39) NFE2L2TSHRCYP3A4RAB9ANPC1
SCHEMBL7970291 0.71 TP53 (0.44) NFE2L2TSHRCYP3A4CYP1A2PKM
SCHEMBL7972136 0.71 POLB (0.46) CYP3A4CYP1A2RAB9ANPC1KMT2A
SCHEMBL348622 0.71 TSHR (0.52) TSHRCYP1A2AMY1APKMRAB9A
SCHEMBL7969857 0.70 NFE2L2 (0.49) NFE2L2CYP1A2KMT2ASMN1; SMN2GRIN2D
SCHEMBL7969371 0.68 NPC1 (0.45) NFE2L2CYP3A4CYP1A2RAB9ANPC1

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-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed