SCHEMBL27427352

SCHEMBL27427352

COc1ccc(Cc2c[c]ccc2)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 2/20 0.42
TTR P02766 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR1E P28566 1/20 0.39
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39
HTR5A P47898 1/20 0.39
HTR6 P50406 1/20 0.39

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
SCHEMBL27425617 0.82 CA2 (0.46) CA2ALDH1A1GAASMN1; SMN2KDM1A
SCHEMBL28319772 0.77 TUBB4A (0.50) CA2HTR2AHTR2CHTR2BTUBB4A
SCHEMBL2032358 0.75 CHRM2 (0.50) MAOBHTR1BLTA4H
SCHEMBL7215264 0.74 LTA4H (0.63) CA2KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL10875496 0.74 CYP19A1 (0.54) CA2SMN1; SMN2MAPT
SCHEMBL2585956 0.73 CALM1 (0.43) LTA4HMAPT
SCHEMBL14740719 0.73 PNMT (0.47)
SCHEMBL4975928 0.73 HTR7 (0.60) KMT2AMEN1ALDH1A1GAAKDM1A
SCHEMBL8900207 0.72 SIGMAR1 (0.37) KMT2AMEN1ALDH1A1HSD17B10SLC6A4
SCHEMBL8914827 0.72 IDO1 (0.43) KMT2AMEN1ALDH1A1GAAHTR1A

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
CN-1110484-C 2-(arylphenyl) amino-imidazoline derivatives HOFMMANN LA ROCHE AG F (CH) 2003-06-04 CN disclosed
CN-1216762-A 2-(arylphenyl) amino-imidazoline derivatives HOFMMANN LA ROCHE AG F (CH) 1999-05-19 CN disclosed