SCHEMBL28210202

SCHEMBL28210202

CC(C)c1ccc(N(N)c2ccc(CN)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
LOXL2 Q9Y4K0 3/20 0.41
PLG P00747 2/20 0.39
KLK1 P06870 2/20 0.39
KLK6 Q92876 2/20 0.39
PYCR1 P32322 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ABAT P80404 1/20 0.35
CSNK2A1 P68400 1/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 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
SCHEMBL84104 0.85 IDO1 (0.58) IDO1LOXL2PLGKLK1KLK6
SCHEMBL28861878 0.79 HRH3 (0.64) IDO1LOXL2PLGKLK1KLK6
SCHEMBL28210267 0.78 TAAR1 (0.46) LOXL2HRH3SMN1; SMN2ABAT
SCHEMBL10528515 0.78 ALDH1A1 (0.44) IDO1KDM4ENPC1HPGDRAB9A
Hydrochloric Acid SCHEMBL9669216 0.76 ADRB2 (0.50) IDO1HPGDRAB9ASMN1; SMN2CNR2
SCHEMBL18232505 0.74 L3MBTL1 (0.54) IDO1LOXL2PLGKLK1KLK6
SCHEMBL12636171 0.74 ST14 (0.61) IDO1LOXL2
SCHEMBL27570005 0.73 HRH3 (0.46) IDO1LOXL2PLGKLK1KLK6
SCHEMBL28300732 0.72 HRH3 (0.50) IDO1LOXL2PLGKLK1KLK6
SCHEMBL1685447 0.71 HRH3 (0.44) LOXL2HRH3KDM4ESMN1; SMN2ABAT

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
CN-105985464-B Solid catalytic component for olefin polymerization and catalyst thereof 中国石油天然气股份有限公司 2018-04-03 CN claimed