SCHEMBL17897787

SCHEMBL17897787

CC(C)(C)OC(=O)n1c2ccccc2c(=O)c2[nH]c3ccccc3c(=O)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
PBRM1 Q86U86 1/20 0.39
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38
GABRA6 Q16445 1/20 0.38
GABRG1 Q8N1C3 1/20 0.38
GABRG3 Q99928 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
SCHEMBL17897786 0.85 CHRM2 (0.50) CHRM2CHRM4CHRM1CHRM3ALDH1A1
SCHEMBL19364971 0.80 KDM4E (0.47) ALDH1A1HPGDHTTMAPTHSD17B10
SCHEMBL8317435 0.78 CDK4 (0.62) MAPTCDK1CCNB2CCNB1GSK3B
SCHEMBL22401390 0.77 CDK4 (0.47) CDK4CCND1
SCHEMBL14396755 0.77 CHRM2 (0.44) CHRM2CHRM4CHRM1CHRM3ALDH1A1
SCHEMBL23875844 0.76 CHRM2 (0.40) CHRM2CHRM4CHRM1CHRM3GABRP
SCHEMBL13696680 0.74 CHRM2 (0.59) CHRM2CHRM4CHRM1CHRM3GABRA1
SCHEMBL30022454 0.74 CHRM2 (0.59) CHRM2CHRM4CHRM1CHRM3GABRA1
SCHEMBL14311393 0.74 CHRM2 (0.48) CHRM2CHRM4CHRM1CHRM3GABRA1
SCHEMBL2256797 0.72 DAO (0.47) NR1H2CA12CA9POLB

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-9768383-B2 Method for applying an organic semiconductor layer based on epindolidione to a carrier UNIVERSITAET LINZ (AT) 2017-09-19 US disclosed
US-20160197279-A1 METHOD FOR APPLYING AN ORGANIC SEMICONDUCTOR LAYER BASED ON EPINDOLIDIONE TO A CARRIER UNIVERSITAET LINZ (AT) 2016-07-07 US disclosed