SCHEMBL8370337

SCHEMBL8370337

O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(Nc2ccccc2)ccc1O

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 1/20 0.70
▸ CDK19 Q9BWU1 1/20 0.70
▸ MEN1 O00255 3/20 0.67
▸ KMT2A Q03164 3/20 0.67
▸ MAPT P10636 1/20 0.67
▸ HTT P42858 1/20 0.67
▸ RAB9A P51151 1/20 0.67
▸ GRIK1 P39086 7/20 0.62
▸ KDR P35968 1/20 0.60
▸ KIF11 P52732 1/20 0.57
▸ IDH2 P48735 1/20 0.57
▸ RXFP1 Q9HBX9 1/20 0.56
▸ MPO P05164 2/20 0.56
▸ TRPV1 Q8NER1 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL5476438 0.90 MEN1 (0.67) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL1462981 0.87 NTRK1 (0.81) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL10217915 0.87 KMT2A (0.88) MEN1KMT2AMAPTHTTRAB9A
SCHEMBL7556107 0.85 NTRK1 (0.70) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL1463407 0.85 NTRK1 (0.77) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL1463167 0.84 KDR (0.73) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL8368351 0.84 RXFP1 (0.62) MEN1KMT2AMAPTHTTRAB9A
SCHEMBL28317079 0.83 IDH2 (0.70) MEN1KMT2AMAPTHTTRAB9A
SCHEMBL1463169 0.82 GRIK1 (0.74) NTRK1CDK19MEN1KMT2AMAPT
SCHEMBL29763181 0.82 NTRK1 (1.00) NTRK1CDK19MEN1KMT2AMAPT

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 4 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 disclosed
US-5696138-A Urea derivatives and their use NEUROSEARCH A/S (DK) 1997-12-09 — — US 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
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