SCHEMBL14394304

SCHEMBL14394304

CCCn1c(CN2CCN=C2c2cc(F)ccc2F)nc2cccnc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.42
TP53 P04637 8/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
PDE2A O00408 2/20 0.35
PDE10A Q9Y233 2/20 0.35
ENPP2 Q13822 5/20 0.34
GPR4 P46093 1/20 0.33

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
SCHEMBL14394314 0.88 TP53 (0.39) SLC6A9TP53MAPTLMNAPOLB
SCHEMBL13099970 0.87 SLC6A9 (0.36) SLC6A9TP53MAPTLMNAPOLB
SCHEMBL14394413 0.86 TP53 (0.41) SLC6A9TP53MAPTGAALMNA
SCHEMBL3065139 0.78 TP53 (0.41) SLC6A9TP53MAPTGAALMNA
SCHEMBL14394153 0.74 LMNA (0.39) TP53MAPTLMNAPDE2APDE10A
SCHEMBL3067316 0.72 TP53 (0.42) SLC6A9TP53MAPTGAALMNA
SCHEMBL3050447 0.70 TP53 (0.41) SLC6A9TP53MAPTGAAPDE2A
SCHEMBL3063113 0.70 TP53 (0.44) SLC6A9TP53MAPTGAALMNA
SCHEMBL14394152 0.69 ALOX5 (0.40) PDE2APDE10A
SCHEMBL3061821 0.69 TP53 (0.42) SLC6A9TP53MAPTGAALMNA

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
US-7300945-B2 Benzimidazole and pyridylimidazole derivatives NEUROGEN CORPORATION (US) 2007-11-27 US disclosed