SCHEMBL6663855

SCHEMBL6663855

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1cscn1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SRPK1 Q96SB4 2/20 0.43
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
HTR2B P41595 1/20 0.42
MTTP P55157 8/20 0.41
APOB P04114 3/20 0.41
SMO Q99835 1/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
NOTUM Q6P988 1/20 0.39
RIPK1 Q13546 1/20 0.39
DGAT2 Q96PD7 1/20 0.39
MAPT P10636 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
SCHEMBL6799258 0.92 SMO (0.49) MTTPAPOBSMOLMNATP53
SCHEMBL6664848 0.88 HTR2A (0.53) SRPK1HTR2AHTR2CHTR2BMTTP
SCHEMBL6667068 0.88 MAPT (0.43) HTR2AHTR2CLMNATP53MAPT
SCHEMBL6666805 0.87 CASP3 (0.43) HTR2AHTR2CHTR2BMTTPAPOB
SCHEMBL6667572 0.85 HTR2A (0.43) HTR2AHTR2CHTR2BMTTPAPOB
SCHEMBL6665118 0.85 RIPK1 (0.43) HTR2AHTR2CHTR2BMTTPAPOB
SCHEMBL6668952 0.85 LMNA (0.41) HTR2AHTR2CHTR2BMTTPAPOB
SCHEMBL6665703 0.84 CYP11B1 (0.49) HTR2AHTR2CHTR2BMTTPAPOB
Hydrochloric Acid SCHEMBL6666545 0.84 RIPK1 (0.43) HTR2AHTR2CHTR2BMTTPAPOB
SCHEMBL6804945 0.83 MAPT (0.46) LMNATP53MAPT

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