SCHEMBL3768908

SCHEMBL3768908

COc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccccc2C(F)(F)F)c1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.72
PPARG P37231 1/20 0.60
RXFP1 Q9HBX9 1/20 0.60
KCNK3 O14649 5/20 0.59
KCNK9 Q9NPC2 5/20 0.59
HPGD P15428 2/20 0.58
GAA P10253 1/20 0.58
EPHX2 P34913 3/20 0.58
F2R P25116 1/20 0.53
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
BCHE P06276 1/20 0.52
PTGS1 P23219 1/20 0.52

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
SCHEMBL3778616 0.90 KCNK3 (0.57) MAPTRXFP1KCNK3KCNK9EPHX2
SCHEMBL3766559 0.88 KCNK3 (0.66) MAPTRXFP1KCNK3KCNK9EPHX2
SCHEMBL3769394 0.87 KCNK3 (0.64) MAPTPPARGRXFP1KCNK3KCNK9
SCHEMBL3769554 0.85 KCNK3 (0.62) MAPTPPARGKCNK3KCNK9EPHX2
SCHEMBL3771423 0.85 KCNK3 (0.61) MAPTRXFP1KCNK3KCNK9EPHX2
SCHEMBL3769343 0.85 LMNA (0.70) MAPTPPARGRXFP1KCNK3KCNK9
SCHEMBL3772610 0.84 KCNK3 (0.58) MAPTKCNK3KCNK9EPHX2F2R
SCHEMBL3770493 0.84 KCNK3 (0.60) MAPTRXFP1KCNK3KCNK9EPHX2
SCHEMBL3768813 0.83 KCNK3 (0.61) MAPTRXFP1KCNK3KCNK9EPHX2
SCHEMBL3767067 0.82 KCNK3 (0.70) PPARGRXFP1KCNK3KCNK9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100324086-A1 COMPOUNDS AND METHODS NOVASAID AB (SE) 2010-12-23 US claimed
WO-2009103778-A1 COMPOUNDS AND METHODS NOVASAID AB (SE) 2009-08-27 WO claimed
US-20100324086-A1 COMPOUNDS AND METHODS NOVASAID AB (SE) 2010-12-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100324086-A1 COMPOUNDS AND METHODS IL1B, LITAF, CYP11B1 MAPT 1426/4885PPARG 1332/4885RXFP1 2716/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.