SCHEMBL28097291

SCHEMBL28097291

OC1=CC(c2ccccc2)(c2ccc(N3CCCCC3)cc2)Cc2cc(N3CCOCC3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 7/20 0.41
TMEM97 Q5BJF2 3/20 0.41
SIGMAR1 Q99720 3/20 0.41
PDK2 Q15119 1/20 0.41
ADRA2A P08913 2/20 0.40
ADRA2B P18089 2/20 0.40
PIK3CD O00329 2/20 0.40
PIK3CA P42336 2/20 0.40
PIK3CB P42338 2/20 0.40
PIK3CG P48736 2/20 0.40
ADRA2C P18825 1/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
DRD4 P21917 1/20 0.38
HRH1 P35367 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL28097254 0.83 AKR1C3 (0.44) PRKDCSLC6A2SLC6A4SLC6A3MAPT
SCHEMBL5158515 0.79 TMEM97 (0.42) PRKDCTMEM97SIGMAR1PDK2ADRA2A
SCHEMBL8107555 0.73 TMEM97 (0.43) PRKDCTMEM97SIGMAR1PDK2ADRA2A
SCHEMBL6687407 0.72 TMEM97 (0.44) PRKDCTMEM97SIGMAR1PDK2ADRA2A
SCHEMBL6245150 0.67 LMNA (0.60) PRKDCLMNAPKMTSHRMAPT
SCHEMBL9092806 0.67 LMNA (0.60) PRKDCLMNAPKMTSHRMAPT
SCHEMBL2175616 0.65 LMNA (0.62) PRKDCLMNAPKMTSHRMAPT
SCHEMBL1240432 0.65 MAPK14 (0.53) PRKDCTMEM97SIGMAR1ADRA2AADRA2B
SCHEMBL10386402 0.64 NPC1 (0.58) PRKDCTMEM97SIGMAR1PDK2ADRA2A
Hydrochloric Acid SCHEMBL11471464 0.64 MAPK14 (0.52) PRKDCTMEM97SIGMAR1ADRA2AADRA2B

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-105873640-A Transfer device for making up keratin materials 欧莱雅 2016-08-17 CN disclosed
CN-105848724-A Cosmetic device comprising a plurality of cosmetic dyes 欧莱雅 2016-08-10 CN disclosed