SCHEMBL11260894

SCHEMBL11260894

CC(C#N)c1cccc2c(-c3ccc(N(C)C)cc3)nccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.34
MAPT P10636 3/20 0.33
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 2/20 0.33
TDO2 P48775 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
MITF O75030 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM1A O60341 1/20 0.33
AURKA O14965 1/20 0.33
ADK P55263 2/20 0.32
KDM4E B2RXH2 2/20 0.32
S100A4 P26447 1/20 0.32
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL11263009 0.85 PIK3CA (0.35) ALDH1A1SMN1; SMN2TDO2KDM4EHPGD
SCHEMBL11260467 0.85 TDO2 (0.42) MAPTALDH1A1LMNATDO2MEN1
SCHEMBL11260164 0.82 TDO2 (0.33) MAPTALDH1A1TDO2AURKA
SCHEMBL11257643 0.79 PSEN1 (0.39) MAPTALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL11254978 0.76 SYK (0.35) SYKMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL11262913 0.74 ALDH1A1 (0.39) SYKMAPTALDH1A1LMNAL3MBTL1
SCHEMBL11497570 0.70 ALDH1A1 (0.40) MAPTALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL2163003 0.69 S100A4 (0.56) SYKMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL11255165 0.69 CNR2 (0.38) SYKMAPTALDH1A1ADKCNR2
SCHEMBL11254442 0.68 KDM4E (0.38) MAPTALDH1A1SMN1; SMN2NPC1RAB9A

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-4337256-A ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) 1982-06-29 US disclosed
EP-0013411-A1 Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them TEIKOKU HORMONE MFG. CO., LTD. (JP) 1980-07-23 EP disclosed