SCHEMBL15526436

SCHEMBL15526436

CCCCOC(C(=O)O)c1c(C)cc2nc(-c3ccnc(-c4cccnc4OC)c3)sc2c1-c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 1/20 0.37
TP53 P04637 6/20 0.35
MAPT P10636 4/20 0.35
LMNA P02545 4/20 0.35
RXFP1 Q9HBX9 1/20 0.35
DHODH Q02127 1/20 0.34
LIPC P11150 1/20 0.32
CTSA P10619 1/20 0.32
LTB4R Q15722 1/20 0.32
RAD52 P43351 1/20 0.31
SCN9A Q15858 1/20 0.31
RARB P10826 1/20 0.31
IDH1 O75874 1/20 0.31
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
TPX2 Q9ULW0 1/20 0.31
CNR1 P21554 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL15332331 0.88 EIF4E (0.38) EIF4ETP53MAPTLMNADHODH
SCHEMBL15333045 0.88 EIF4E (0.38) EIF4ETP53MAPTLMNADHODH
SCHEMBL15342045 0.85 EIF4E (0.37) EIF4ETP53MAPTLMNADHODH
SCHEMBL15342417 0.84 EIF4E (0.35) EIF4ETP53MAPTLMNARXFP1
SCHEMBL15526380 0.83 MAPT (0.33) MAPTRXFP1
SCHEMBL15526437 0.83 EIF4E (0.35) EIF4ETP53MAPTLMNARXFP1
SCHEMBL17547091 0.82 EIF4E (0.41) EIF4ETP53MAPTLMNADHODH
SCHEMBL15526305 0.81 MAPT (0.35) MAPTRXFP1DHODHRARB
SCHEMBL15526260 0.81 MAPT (0.32) MAPTRXFP1
SCHEMBL15526216 0.81 MAPT (0.39) TP53MAPTLMNARXFP1DHODH

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-2788336-A1 BENZOTHIAZOL- 6 -YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION Gilead Sciences, Inc. (US) 2014-10-15 EP disclosed
WO-2013159064-A1 BENZOTHIAZOL- 6 -YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION GILEAD SCIENCES, INC. (US) 2013-10-24 WO disclosed