SCHEMBL11979705

SCHEMBL11979705

COc1ccc2c(Cc3cccc(C4=NNNN4)n3)c(-c3ccccc3)n(C)c2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PAX8 Q06710 1/20 0.34
GRIK2 Q13002 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 3/20 0.32
TSHR P16473 1/20 0.32
MAOA P21397 1/20 0.32
MPO P05164 1/20 0.32
ABCB1 P08183 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL11979697 0.80 TUBB4A (0.43) PDE10AKMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL15975188 0.78 PDE10A (0.42) PDE10AMEN1KMT2APAX8ALDH1A1
SCHEMBL4568142 0.78 PTGER1 (0.46) MEN1KMT2A
SCHEMBL4568124 0.76 MEN1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL11979702 0.74 PDE10A (0.39) PDE10AMEN1KMT2AALDH1A1KDM4E
SCHEMBL15975201 0.73 PDE10A (0.38) PDE10AMEN1KMT2AALDH1A1KDM4E
SCHEMBL11979710 0.73 ALDH1A1 (0.44) PDE10AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL15975203 0.73 PDE10A (0.38) PDE10AMEN1KMT2AALDH1A1KDM4E
SCHEMBL11979709 0.73 CYP19A1 (0.48) PDE10A
SCHEMBL11978295 0.72 PDE10A (0.37) PDE10AMEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815903-B2 Indole derivative and pharmacologically acceptable salt thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2014-08-26 US disclosed
US-8815903-B2 Indole derivative and pharmacologically acceptable salt thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2014-08-26 US disclosed
WO-2012102255-A1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT OF SAME キッセイ薬品工業株式会社 (JP) 2012-08-02 WO disclosed