SCHEMBL8726008

SCHEMBL8726008

CC(C)(CO)Nc1c(N)cnc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
CCNE2 O96020 1/20 0.45
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
ATM Q13315 1/20 0.41
CACNA2D1 P54289 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM1A O60341 1/20 0.38
LATS1 O95835 1/20 0.37
LATS2 Q9NRM7 1/20 0.37
NCF1 P14598 1/20 0.37
LRRK2 Q5S007 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MITF O75030 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL29730779 0.83 ATM (0.59) CYP1A2CCNE2CDK4CCND1CCNE1
SCHEMBL8726007 0.83 ATM (0.59) CYP1A2CCNE2CDK4CCND1CCNE1
SCHEMBL4307994 0.81 NUDT1 (0.44) CYP1A2ATMNPSR1MEN1PKM
SCHEMBL8725659 0.78 SMN1; SMN2 (0.44) CYP1A2CCNE2CDK4CCND1CCNE1
SCHEMBL12665011 0.77 POLB (0.44) MEN1PKMKMT2AKDM1ANCF1
SCHEMBL842750 0.77 TLR7 (0.38) CYP1A2ATMNPSR1MEN1PKM
SCHEMBL14345376 0.77 ATM (0.39) CYP1A2ATMMEN1PKMKMT2A
SCHEMBL9212223 0.75 LRRK2 (0.46) ATMKDM1ANCF1LRRK2KDM4E
SCHEMBL6493232 0.75 KDM4E (0.61) MEN1PKMKMT2ANCF1KDM4E
SCHEMBL9380148 0.74 LRRK2 (0.45) CACNA2D1MEN1PKMKMT2ANCF1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756747-A 1H-imidazo 4,5-c!quinolin-4-amines RIKER LABORATORIES, INC. (US) 1998-05-26 US disclosed
EP-0385630-B1 1H-imidazo(4,5-c)Quinolin-4-amines as antivirals RIKER LABORATORIES INC (US) 1996-11-27 EP disclosed
EP-0389302-B1 Olefinic 1H-imidazo [4,5-c]quinolin-4-amines RIKER LABORATORIES INC (US) 1994-08-31 EP disclosed
US-5037986-A Olefinic 1H-imidazo[4,5-c]quinolin-4-amines MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-06 US disclosed
EP-0389302-A1 Olefinic 1H-imidazo [4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-09-26 EP disclosed
EP-0385630-A2 1H-imidazo(4,5-c)Quinolin-4-amines as antivirals RIKER LABORATORIES, INC. (US) 1990-09-05 EP disclosed