SCHEMBL10345865

SCHEMBL10345865

CSc1ccccc1N1C=CC=Cc2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
HCAR1 Q9BXC0 1/20 0.31
KCNN4 O15554 1/20 0.31
P2RX4 Q99571 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
SCHEMBL19284163 0.74 MGLL (0.40) LMNATSHRMAPK1P2RX4
SCHEMBL3732224 0.73 P2RX4 (0.35) ALDH1A1LMNATSHRMAPK1P2RX4
SCHEMBL10720430 0.72 P2RX4 (0.33) LMNATSHRMAPK1P2RX4
SCHEMBL693565 0.70 LMNA (0.32) LMNATSHRMAPK1P2RX4
SCHEMBL1249107 0.69 MTNR1A (0.39) ALDH1A1LMNATSHRMAPK1P2RX4
SCHEMBL1246144 0.69 LMNA (0.39) ALDH1A1LMNATSHRMAPK1P2RX4
SCHEMBL11498008 0.67
SCHEMBL6312853 0.66 LMNA (0.41) LMNATSHRMAPK1P2RX4
SCHEMBL7518490 0.65 LMNA (0.39) ALDH1A1LMNATSHRMAPK1P2RX4
SCHEMBL7414781 0.65 LMNA (0.35) LMNATSHRMAPK1P2RX4

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
EP-0230755-B1 1-PHENYL-3-BENZAZEPINES SMITHKLINE BEECHAM CORPORATION (US) 1990-05-16 EP disclosed
US-4707483-A 1-phenyl-3-benzazepines and their use for treating gastrointestinal motility disorders SMITHKLINE BECKMAN CORPORATION (US) 1987-11-17 US disclosed
EP-0230755-A1 1-Phenyl-3-benzazepines SMITHKLINE BEECHAM CORPORATION (US) 1987-08-05 EP disclosed