SCHEMBL9837883

SCHEMBL9837883

CC(F)(COC1CCCCC1)c1ccc(N)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.39
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
KIF11 P52732 1/20 0.33
MAOB P27338 2/20 0.33
CYP19A1 P11511 1/20 0.32
NPY1R P25929 1/20 0.31
NPY2R P49146 1/20 0.31
NPY4R P50391 1/20 0.31
NPY5R Q15761 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
HSD11B1 P28845 1/20 0.30
PDE4A P27815 1/20 0.30

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
SCHEMBL9837596 0.98 NFE2L2 (0.36) NFE2L2NPC1MAPTRAB9AALDH1A1
SCHEMBL9837533 0.76 EPHX1 (0.38) NFE2L2NPC1MAPTRAB9AALDH1A1
SCHEMBL9837839 0.75 NFE2L2 (0.47) NFE2L2NPC1MAPTRAB9AALDH1A1
SCHEMBL9837549 0.74 ALDH1A1 (0.36) NFE2L2NPC1MAPTRAB9AALDH1A1
SCHEMBL9838902 0.73 NFE2L2 (0.45) NFE2L2NPC1MAPTRAB9AALDH1A1
SCHEMBL9837608 0.71 CYP19A1 (0.51) NPC1RAB9ACYP19A1HSD11B1
SCHEMBL8292382 0.70 MAPT (0.36) NPC1MAPTRAB9AALDH1A1HPGD
SCHEMBL9837262 0.69 CYP19A1 (0.49) NPC1RAB9ACYP19A1
SCHEMBL9839149 0.69 NFE2L2 (0.41) NFE2L2MAPTALDH1A1PDE4A
SCHEMBL9837903 0.68 CYP19A1 (0.45) RAB9ACYP19A1

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
EP-0276122-B1 CYCLOALKYL-SUBSTITUTED 4-AMINOPHENYL HALO DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-08-07 EP claimed