SCHEMBL16199544

SCHEMBL16199544

Nc1cccc(-c2ccnc3[nH]cc(C(=O)c4cccc(P)c4)c23)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.44
NTRK1 P04629 1/20 0.42
PIK3CA P42336 1/20 0.42
DYRK1A Q13627 1/20 0.42
LRRK2 Q5S007 6/20 0.40
KIT P10721 1/20 0.39
FYN P06241 4/20 0.39
BTK Q06187 2/20 0.38
NEK2 P51955 1/20 0.38
MAP4K4 O95819 1/20 0.37
NEK1 Q96PY6 1/20 0.37
PKM P14618 1/20 0.36
STK4 Q13043 1/20 0.36
STK3 Q13188 1/20 0.36
EGFR P00533 1/20 0.36

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
SCHEMBL1363679 0.88 LRRK2 (0.51) PRKCINTRK1PIK3CADYRK1ALRRK2
SCHEMBL1363467 0.87 LRRK2 (0.55) PRKCINTRK1DYRK1ALRRK2KIT
SCHEMBL857026 0.84 LRRK2 (0.46) PRKCINTRK1PIK3CADYRK1ALRRK2
SCHEMBL856956 0.81 BTK (0.48) LRRK2BTK
SCHEMBL856928 0.80 LRRK2 (0.43) PRKCINTRK1PIK3CADYRK1ALRRK2
SCHEMBL857272 0.79 LRRK2 (0.43) PRKCINTRK1PIK3CADYRK1ALRRK2
SCHEMBL856963 0.78 FYN (0.45) NTRK1PIK3CADYRK1ALRRK2KIT
SCHEMBL857164 0.78 LRRK2 (0.40) PRKCINTRK1PIK3CADYRK1ALRRK2
SCHEMBL859106 0.78 FYN (0.44) NTRK1PIK3CADYRK1ALRRK2KIT
SCHEMBL858237 0.78 LRRK2 (0.56) PRKCINTRK1DYRK1ALRRK2FYN

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
EP-1696920-B1 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON INC (US) 2014-10-29 EP disclosed