SCHEMBL8370324

SCHEMBL8370324

O=C(Cc1cccc(C(F)(F)F)c1)Nc1cc(Cl)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.63
CDK19 Q9BWU1 1/20 0.63
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 3/20 0.60
MAPT P10636 3/20 0.60
CHRNA7 P36544 1/20 0.56
ALOX15 P16050 1/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KCNQ2 O43526 1/20 0.55
POLB P06746 1/20 0.53
PARP14 Q460N5 1/20 0.53
P2RY14 Q15391 1/20 0.52
SLC2A1 P11166 1/20 0.52
P2RX1 P51575 1/20 0.52
P2RX4 Q99571 1/20 0.52
P2RX7 Q99572 1/20 0.52
TMPRSS4 Q9NRS4 1/20 0.52
MAPK8 P45983 1/20 0.51

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
SCHEMBL8371719 0.84 MAPT (0.60) MEN1KMT2ALMNAMAPTPOLB
SCHEMBL7734705 0.82 MAPK1 (0.74) MEN1KMT2ALMNAALOX15MAPK1
SCHEMBL29373364 0.81 MEN1 (0.61) MEN1KMT2AMAPTCHRNA7ALOX15
SCHEMBL1850010 0.79 MEN1 (0.68) MEN1KMT2ALMNAMAPTKCNQ2
SCHEMBL826590 0.79 MEN1 (0.61) MEN1KMT2ALMNAMAPTKCNQ2
SCHEMBL825921 0.78 MEN1 (0.59) MEN1KMT2ALMNAMAPTKCNQ2
SCHEMBL1853620 0.78 MEN1 (0.62) MEN1KMT2ALMNAMAPTKCNQ2
SCHEMBL1463468 0.78 NTRK1 (1.00) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL29763181 0.78 NTRK1 (1.00) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL31240786 0.77 RIOK2 (0.62) MEN1KMT2ALMNAMAPTKCNQ2

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