SCHEMBL8368359

SCHEMBL8368359

COc1ccc(C(F)(F)F)cc1NC(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
RAF1 P04049 7/20 0.55
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
BRAF P15056 1/20 0.52
CHRNA7 P36544 1/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 2/20 0.51
ALDH1A1 P00352 1/20 0.51
P2RY1 P47900 1/20 0.51
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.49
IGF1R P08069 1/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL31440788 0.88 KMT2A (0.61) MAPTMEN1KMT2ARAF1CYP1A2
SCHEMBL3675685 0.86 CHRNA7 (0.70) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL4246258 0.86 RAB9A (0.60) MAPTMEN1KMT2ARAF1ALDH1A1
SCHEMBL3476076 0.84 RAF1 (0.61) MAPTMEN1KMT2ARAF1BRAF
SCHEMBL4243486 0.84 RAF1 (0.61) MAPTMEN1KMT2ARAF1BRAF
SCHEMBL4247303 0.84 MEN1 (0.64) MAPTMEN1KMT2ARAF1BRAF
SCHEMBL8370028 0.84 GRIK1 (0.65) MAPTMEN1KMT2ARAF1ALDH1A1
SCHEMBL4239103 0.83 RAF1 (0.54) MAPTMEN1KMT2ARAF1BRAF
SCHEMBL5445313 0.82 RAF1 (0.60) MAPTMEN1KMT2ARAF1BRAF
SCHEMBL8372525 0.82 NTRK1 (0.71) MAPTMEN1KMT2AKDM4ELMNA

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