SCHEMBL5261402

SCHEMBL5261402

CCOc1ccc(Nc2cccc(-c3nccs3)n2)nc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.40
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39
SRC P12931 3/20 0.39
ZAP70 P43403 3/20 0.39
CDK2 P24941 1/20 0.39
LYN P07948 1/20 0.39
ADORA2A P29274 1/20 0.39
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PKM P14618 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
SCHEMBL4899241 0.88 CYP1A1 (0.48) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL4899309 0.83 SYK (0.40) SYKCYP1A1CYP1A2CYP1B1SRC
Hydrochloric Acid SCHEMBL27662732 0.82 SYK (0.40) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL4899942 0.82 LYN (0.49) SYKSRCZAP70CDK2LYN
SCHEMBL27682328 0.81 SYK (0.39) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL4901619 0.81 EGFR (0.39) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL27682361 0.80 ADORA2A (0.44) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL27682381 0.80 SYK (0.38) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL4896690 0.79 SYK (0.49) SYKCYP1A1CYP1A2CYP1B1SRC
SCHEMBL4901358 0.79 SLC2A1 (0.49) SYKCYP1A1CYP1A2CYP1B1SRC

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
EP-1737852-A2 POLYCYCLIC PYRIDINES AS POTASSIUM ION CHANNEL MODULATORS Icagen, Inc. (US) 2007-01-03 EP disclosed
WO-2005100349-A2 POLYCYCLIC PYRIDINES AS POTASSIUM ION CHANNEL MODULATORS ICAGEN, INC. (US) 2005-10-27 WO disclosed