SCHEMBL8207380

SCHEMBL8207380

Fc1ccc(C(CCCN2CCC(Cc3nc4cccnc4n3Cc3ccccc3)CC2)c2ccc(F)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.78
ENPP2 Q13822 8/20 0.45
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
SLC6A2 P23975 1/20 0.43
TP53 P04637 2/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 3/20 0.43

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
SCHEMBL8206297 0.97 SLC6A9 (0.79) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL8212306 0.92 SLC6A9 (0.76) SLC6A9ENPP2SLC6A4SLC6A3SLC6A2
SCHEMBL8207198 0.88 SLC6A9 (1.00) SLC6A9ENPP2TP53MAPT
SCHEMBL8211327 0.88 SLC6A9 (0.75) SLC6A9ENPP2SLC6A4SLC6A3SLC6A2
SCHEMBL9535367 0.86 SLC6A9 (0.58) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL9537085 0.83 SLC6A9 (0.58) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL9535785 0.83 SLC6A9 (0.58) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL9537927 0.82 LMNA (0.55) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL9537811 0.82 SLC6A9 (0.60) SLC6A9ENPP2TP53MAPTLMNA
SCHEMBL9535970 0.81 SLC6A9 (0.55) SLC6A9ENPP2TP53MAPTLMNA

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-1059922-A2 GLYCINE TRANSPORT INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2000-12-20 EP disclosed
WO-1999044596-A2 GLYCINE TRANSPORT INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 1999-09-10 WO disclosed