SCHEMBL9640753

SCHEMBL9640753

O=C(c1cccc2ccccc12)c1cccc2[nH]ccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 2/20 0.57
GPR84 Q9NQS5 1/20 0.56
MEN1 O00255 2/20 0.51
MAPT P10636 2/20 0.51
KMT2A Q03164 2/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TUBB4A P04350 1/20 0.51
TUBB P07437 1/20 0.51
TUBA3C P0DPH7 1/20 0.51
TUBA1B P68363 1/20 0.51
TUBA4A P68366 1/20 0.51
TUBB4B P68371 1/20 0.51
TUBB3 Q13509 1/20 0.51
TUBB2A Q13885 1/20 0.51
TUBB8 Q3ZCM7 1/20 0.51
TUBA3E Q6PEY2 1/20 0.51
TUBA1A Q71U36 1/20 0.51

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
SCHEMBL29489280 0.87 GPR84 (0.77) CDC25BGPR84MEN1MAPTKMT2A
SCHEMBL8530849 0.87 GPR84 (0.77) CDC25BGPR84MEN1MAPTKMT2A
SCHEMBL9450062 0.83 GPR84 (0.51) GPR84MEN1KMT2ATUBB4ATUBB
SCHEMBL3943383 0.82 TUBB4A (0.50) GPR84TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL244802 0.82 CDC25B (0.80) CDC25BMEN1MAPTKMT2AHTT
SCHEMBL29414437 0.82 CDC25B (0.80) CDC25BMEN1MAPTKMT2AHTT
SCHEMBL9266240 0.81 TUBB4A (0.59) GPR84MAPTNPSR1TUBB4ATUBB
SCHEMBL9640522 0.80 TUBB4A (0.55) GPR84MEN1MAPTKMT2ANPSR1
Hydrochloric Acid SCHEMBL27713225 0.80 CDC25B (0.77) CDC25BMEN1MAPTKMT2AHTT
SCHEMBL40257 0.77 NAPRT (0.52) GPR84MAPTTUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0278265-B1 1- [(4-Morpholinyl) alkyl] -1H-indoles useful as analgesics and preparation thereof STERLING WINTHROP INC. (US) 1992-09-09 EP disclosed
US-5081122-A Antiglaucoma compositions containing 4-arylcarbonyl-1-(4-morpholinyl)-lower-alkyl)-1H-indoles and method of use thereof STERLING DRUG INC. (US) 1992-01-14 US disclosed
US-4874761-A ANALGESICS STERLING DRUG INC. (US) 1989-10-17 US disclosed
US-4840950-A ANALGESICS STERLING DRUG INC. (US) 1989-06-20 US disclosed
EP-0278265-A1 1- [(4-Morpholinyl) alkyl] -1H-indoles useful as analgesics and preparation thereof STERLING WINTHROP INC. (US) 1988-08-17 EP disclosed