SCHEMBL15975201

SCHEMBL15975201

COc1ccc2c(Cc3cccc(C4=NNNN4)n3)c(C(C)C)[nH]c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.38
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
DYRK1A Q13627 4/20 0.34
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
GPR17 Q13304 1/20 0.32
KMT2A Q03164 2/20 0.32
MPO P05164 1/20 0.32
CYP19A1 P11511 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2E1 P05181 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C8 P10632 1/20 0.31

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
SCHEMBL15975133 0.92 PDE10A (0.37) PDE10ADYRK1AALDH1A1KDM4ERXFP1
SCHEMBL11979702 0.86 PDE10A (0.39) PDE10ADYRK1AALDH1A1KDM4EGPR17
SCHEMBL15975130 0.84 PDE10A (0.36) PDE10A
SCHEMBL15975203 0.84 PDE10A (0.38) PDE10AMTNR1AMTNR1BDYRK1AALDH1A1
SCHEMBL11979697 0.84 TUBB4A (0.43) PDE10AMTNR1AMTNR1BALDH1A1KDM4E
SCHEMBL11978295 0.83 PDE10A (0.37) PDE10ADYRK1AALDH1A1KDM4EGPR17
SCHEMBL11979709 0.82 CYP19A1 (0.48) PDE10ACYP19A1
SCHEMBL15975112 0.82 MTNR1A (0.40) PDE10AMTNR1AMTNR1BDYRK1AALDH1A1
SCHEMBL11979710 0.81 ALDH1A1 (0.44) PDE10AMTNR1AMTNR1BDYRK1AALDH1A1
SCHEMBL11979699 0.81 TUBB4A (0.44) PDE10ACYP19A1NPC1

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-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