SCHEMBL7997832

SCHEMBL7997832

CC(N)(Cn1ccc2ccc(Cl)cc21)OC(=O)/C=C/C(=O)OC(C)(N)Cn1ccc2ccc(Cl)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.48
HTR7 P34969 1/20 0.38
ACLY P53396 1/20 0.38
OXER1 Q8TDS5 1/20 0.38
MCL1 Q07820 2/20 0.37
FFAR1 O14842 1/20 0.37
PPARG P37231 1/20 0.37
NPY5R Q15761 1/20 0.35
AR P10275 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
CCR9 P51686 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
APOBEC3A P31941 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL27524962 0.91 HTR2A (0.46) KMOACLYOXER1NPY5RAR
SCHEMBL8959588 0.91 HTR2A (0.46) KMOACLYOXER1NPY5RAR
SCHEMBL27528051 0.87 HTR2A (0.45) KMOHTR7MCL1HTR2AHTR2C
SCHEMBL8959581 0.87 HTR2A (0.45) KMOHTR7MCL1HTR2AHTR2C
SCHEMBL8959562 0.86 HTR2C (0.46) HTR7PPARGNPY5RARHTR2A
SCHEMBL27356666 0.86 HTR2C (0.46) HTR7PPARGNPY5RARHTR2A
SCHEMBL8959864 0.83 HTR2A (0.49) KMOARHTR2AHTR2C
SCHEMBL8959561 0.83 HTR2A (0.49) KMOARHTR2AHTR2C
SCHEMBL8959713 0.83 HTR2A (0.49) KMOARHTR2AHTR2C
SCHEMBL27363223 0.83 HTR2A (0.49) KMOARHTR2AHTR2C

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-2001040183-A1 1-AMINOALKYL-1H-INDOLES FOR TREATING GLAUCOMA ALCON UNIVERSAL LTD. (CH) 2001-06-07 WO disclosed