SCHEMBL6667072

SCHEMBL6667072

Nc1nc(CC(=O)N2CCc3cc(NC(=O)c4cc(C(F)(F)F)ccc4-c4ccccc4)ccc32)ns1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTTP P55157 9/20 0.40
APOB P04114 6/20 0.40
LMNA P02545 3/20 0.39
TP53 P04637 1/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
NTRK1 P04629 1/20 0.39
CYP1A2 P05177 1/20 0.39
LCK P06239 1/20 0.39
YES1 P07947 1/20 0.39
RET P07949 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2D6 P10635 1/20 0.39
KIT P10721 1/20 0.39
CYP2C9 P11712 1/20 0.39
EIF2AK2 P19525 1/20 0.39
AXL P30530 1/20 0.39
CYP2C19 P33261 1/20 0.39
NEK4 P51957 1/20 0.39

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
SCHEMBL6805303 0.92 MTTP (0.46) MTTPAPOBLMNATP53MAPT
SCHEMBL6665118 0.85 RIPK1 (0.43) MTTPAPOBLMNAHTR2AHTR2C
Hydrochloric Acid SCHEMBL6666545 0.84 RIPK1 (0.43) MTTPAPOBLMNAHTR2AHTR2C
SCHEMBL6667572 0.84 HTR2A (0.43) MTTPAPOBLMNAHTR2AHTR2C
SCHEMBL6805189 0.83 MTTP (0.47) MTTPAPOB
SCHEMBL6665703 0.83 CYP11B1 (0.49) MTTPAPOBLMNATP53HTR2A
SCHEMBL6664848 0.82 HTR2A (0.53) MTTPAPOBHTR2AHTR2CRIPK1
SCHEMBL6666805 0.82 CASP3 (0.43) MTTPAPOBLMNATP53HTR2A
SCHEMBL6663855 0.82 SRPK1 (0.43) MTTPAPOBLMNATP53HTR2A
SCHEMBL6666916 0.81 CYP11B1 (0.55) MTTPAPOBHTR2AHTR2CCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed