SCHEMBL15975192

SCHEMBL15975192

O=c1[nH]c(-c2cccc(Cc3c(-c4ccoc4)[nH]c4cc(C5CC5)ccc34)n2)no1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
TLR9 Q9NR96 6/20 0.33
TLR8 Q9NR97 6/20 0.33
TLR7 Q9NYK1 6/20 0.33
HTR2A P28223 1/20 0.32
NR3C1 P04150 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
SCHEMBL11978661 0.90 NR3C1 (0.36) TLR9TLR8TLR7NR3C1BRD4
SCHEMBL15975190 0.86 TUBB4A (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL11978281 0.84 TUBB4A (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15975131 0.81 TUBB4A (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15975110 0.80 TLR9 (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL11978659 0.76 MDM4 (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL11978656 0.74 PDE10A (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15975107 0.73 PDE10A (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15975106 0.72 TUBB4A (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15975094 0.72 CYP19A1 (0.47)

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