SCHEMBL3969346

SCHEMBL3969346

CCOC(=O)Cc1c(C)c(Cc2sccc2Sc2ccc(F)cc2)n2cc(C#N)ccc12

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
MAPT P10636 3/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 1/20 0.31
ALOX15 P16050 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
SLC34A1 Q06495 1/20 0.30

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
SCHEMBL3967762 0.90 PTGDR2 (0.38)
SCHEMBL3967751 0.83 PTGDR2 (0.39) MEN1KMT2ASMN1; SMN2MAPTLMNA
SCHEMBL3970488 0.83 SMN1; SMN2 (0.32) MEN1KMT2ASMN1; SMN2MAPTLMNA
SCHEMBL3968018 0.79 PTGDR2 (0.39) MEN1KMT2ASMN1; SMN2MAPTLMNA
SCHEMBL3962109 0.77 PTGDR2 (0.39) MEN1KMT2AMAPTLMNATSHR
SCHEMBL3969206 0.76 SLC6A4 (0.37) MEN1KMT2AMAPTL3MBTL1
SCHEMBL3973410 0.74 PTGDR2 (0.33) MEN1KMT2ASMN1; SMN2SLC34A1
SCHEMBL3969463 0.74 PTGDR2 (0.47) MEN1KMT2AMAPT
SCHEMBL3968452 0.73 PTGDR2 (0.46)
SCHEMBL3577485 0.73 TSHR (0.38) MEN1KMT2ASMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009044147-A1 INDOLIZINE DERIVATIVES WITH CRTH2 RECEPTOR AFFINITY FOR THE TREATMENT OF INFLAMMATORY DISEASES ARGENTA DISCOVERY LIMITED (GB) 2009-04-09 WO disclosed