SCHEMBL8370331

SCHEMBL8370331

Oc1ccc(Cl)cc1NC(=S)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.75
ALDH1A1 P00352 8/20 0.75
KMT2A Q03164 7/20 0.75
MEN1 O00255 6/20 0.75
CYP1A2 P05177 2/20 0.75
CYP3A4 P08684 2/20 0.75
CYP2D6 P10635 2/20 0.75
CYP2C19 P33261 2/20 0.75
POLB P06746 1/20 0.75
CYP2C9 P11712 1/20 0.75
XBP1 P17861 1/20 0.75
NTRK1 P04629 1/20 0.73
CDK19 Q9BWU1 1/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
NPSR1 Q6W5P4 5/20 0.64
GAA P10253 4/20 0.64
TDP1 Q9NUW8 2/20 0.64
KDM4E B2RXH2 2/20 0.64
L3MBTL1 Q9Y468 2/20 0.62
SLC2A1 P11166 1/20 0.60

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
SCHEMBL8368225 0.89 MAPT (0.66) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL4353931 0.85 TMPRSS4 (0.58) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL24169274 0.85 MAPT (1.00) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL30387868 0.85 MAPT (1.00) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL8543673 0.85 NTRK1 (0.77) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL1463468 0.85 NTRK1 (1.00) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL29763181 0.85 NTRK1 (1.00) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL8370285 0.83 GAA (0.71) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL7175227 0.82 MAPT (0.86) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL2838244 0.82 CHRNA7 (0.76) MAPTALDH1A1KMT2AMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-5696138-A Urea derivatives and their use NEUROSEARCH A/S (DK) 1997-12-09 US claimed
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 claimed
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 claimed
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