SCHEMBL8370285

SCHEMBL8370285

COc1ccc(Cl)cc1NC(=S)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.71
ALDH1A1 P00352 11/20 0.69
MAPT P10636 10/20 0.69
KMT2A Q03164 8/20 0.69
MEN1 O00255 6/20 0.69
CYP1A2 P05177 2/20 0.69
CYP3A4 P08684 2/20 0.69
CYP2D6 P10635 2/20 0.69
CYP2C19 P33261 2/20 0.69
POLB P06746 1/20 0.69
CYP2C9 P11712 1/20 0.69
XBP1 P17861 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.67
KDM4E B2RXH2 3/20 0.61
LMNA P02545 2/20 0.60
HPGD P15428 1/20 0.60
NPSR1 Q6W5P4 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
L3MBTL1 Q9Y468 2/20 0.57
HTT P42858 1/20 0.55

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
SCHEMBL8370699 0.90 ALDH1A1 (0.65) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL7168388 0.86 NTRK1 (0.55) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL8372525 0.86 NTRK1 (0.71) MAPTKMT2AMEN1POLBSMN1; SMN2
SCHEMBL28398542 0.84 GAA (0.76) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL30362785 0.84 GAA (0.76) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL30362755 0.83 GAA (0.77) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL8370331 0.83 MAPT (0.75) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL28401851 0.83 GAA (0.77) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL5450034 0.82 GAA (0.76) GAAALDH1A1MAPTKMT2AMEN1
SCHEMBL24169274 0.81 MAPT (1.00) GAAALDH1A1MAPTKMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0910358-A1 PHENYL DERIVATIVES USEFUL AS BLOCKERS OF CHLORIDE CHANNELS NEUROSEARCH A/S (DK) 1999-04-28 EP disclosed
EP-0693053-B1 UREA AND AMIDE DERIVATIVES AND THEIR USE IN THE CONTROL OF CELL MEMBRANE POTASSIUM CHANNELS NEUROSEARCH AS (DK) 1999-01-20 EP disclosed
US-5696138-A Urea derivatives and their use NEUROSEARCH A/S (DK) 1997-12-09 US disclosed
WO-1997045111-A1 PHENYL DERIVATIVES USEFUL AS BLOCKERS OF CHLORIDE CHANNELS NEUROSEARCH A/S (DK) 1997-12-04 WO disclosed
EP-0693053-A1 UREA AND AMIDE DERIVATIVES AND THEIR USE IN THE CONTROL OF CELL MEMBRANE POTASSIUM CHANNELS NEUROSEARCH A/S (DK) 1996-01-24 EP disclosed
WO-1994022807-A1 UREA AND AMIDE DERIVATIVES AND THEIR USE IN THE CONTROL OF CELL MEMBRANE POTASSIUM CHANNELS NEUROSEARCH A/S (DK) 1994-10-13 WO disclosed