SCHEMBL2265767

SCHEMBL2265767

Cc1cccc(C(=O)CC(=O)C(F)(F)C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.48
HPGD P15428 4/20 0.48
HTT P42858 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
LMNA P02545 2/20 0.48
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
PARP1 P09874 1/20 0.46
RAB9A P51151 3/20 0.45
KCNK3 O14649 2/20 0.45
KCNK9 Q9NPC2 2/20 0.45
KCNH2 Q12809 2/20 0.45
NPC1 O15118 2/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CTNNB1 P35222 2/20 0.44

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
SCHEMBL2265334 0.91 SMN1; SMN2 (0.46) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL1924595 0.87 PLOD2 (0.54) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL2265395 0.84 SMN1; SMN2 (0.51) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL28728190 0.81 MEN1 (0.64) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL29456641 0.81 MEN1 (0.64) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL2261881 0.81 CTNNB1 (0.48) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL1682774 0.80 MEN1 (0.59) SMN1; SMN2HPGDMEN1KMT2AKDM4E
SCHEMBL10526131 0.78 PARP1 (0.53) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL23380027 0.77 SMN1; SMN2 (0.50) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL3675566 0.76 MEN1 (0.69) SMN1; SMN2HPGDHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
EP-1465869-A4 MODULATORS OF LXR X CEPTOR THERAPEUTICS INC (US) 2005-12-28 EP disclosed
EP-1465869-A1 MODULATORS OF LXR X-Ceptor Therapeutics, Inc. (US) 2004-10-13 EP disclosed
US-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS, INC. 2003-09-25 US disclosed
WO-2003059884-A1 MODULATORS OF LXR X-CEPTOR THERAPEUTICS, INC. (US) 2003-07-24 WO 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-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors NR1H2, NR1H3, NCOA1 SMN1; SMN2 4327/4885HPGD 374/4885HTT 4559/4885

“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.