SCHEMBL16601853

SCHEMBL16601853

Cc1ccc2c(c1)N/C(=C1/Nc3ccccc3C1=O)C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1G1 Q9HCP0 1/20 0.57
MAOA P21397 6/20 0.53
MAOB P27338 6/20 0.53
ELANE P08246 1/20 0.52
CDK5 Q00535 2/20 0.51
ROS1 P08922 1/20 0.51
ACVR1 Q04771 1/20 0.51
LRRK2 Q5S007 1/20 0.51
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 5/20 0.42
ALOX15 P16050 1/20 0.42
LMNA P02545 2/20 0.42
CCNB2 O95067 1/20 0.42
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
GSK3B P49841 1/20 0.42
CDK5R1 Q15078 1/20 0.42
CCNB3 Q8WWL7 1/20 0.42

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
SCHEMBL13892935 0.90 CDK5 (0.60) CSNK1G1MAOAMAOBELANECDK5
Indigo SCHEMBL56085 0.83 MAOA (0.67) MAOAMAOBACVR1LRRK2ALDH1A1
Indigo SCHEMBL29829264 0.83 MAOA (0.67) MAOAMAOBACVR1LRRK2ALDH1A1
Indigo SCHEMBL29583322 0.83 MAOA (0.67) MAOAMAOBACVR1LRRK2ALDH1A1
Indigo SCHEMBL42280 0.83 MAOA (0.67) MAOAMAOBACVR1LRRK2ALDH1A1
Indigo SCHEMBL320595 0.83 MAOA (0.67) MAOAMAOBACVR1LRRK2ALDH1A1
SCHEMBL24403047 0.81 CES1 (0.64) CSNK1G1MAOAMAOBELANEALDH1A1
SCHEMBL3851538 0.80 ACVR1 (0.60) CSNK1G1MAOAMAOBELANECDK5
SCHEMBL13879091 0.80 ACVR1 (0.60) CSNK1G1MAOAMAOBELANECDK5
SCHEMBL14063427 0.80 ACVR1 (0.60) CSNK1G1MAOAMAOBELANECDK5

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
US-11917897-B2 Photo-patternable organic semiconductor (OSC) polymers for organic thin-film transistors CORNING INCORPORATED (US) 2024-02-27 US disclosed
US-8993659-B2 Rubber composition and pneumatic tire THE YOKOHAMA RUBBER COMPANY, LIMITED (JP) 2015-03-31 US disclosed