SCHEMBL965522

SCHEMBL965522

CCCCCNS(=O)(=O)NC(=O)C=Cc1c(C)nn(C)c1-n1ccc2cc(Cl)ccc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.37
MAPT P10636 1/20 0.36
NR2F2 P24468 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR1 P21554 6/20 0.33
CNR2 P34972 5/20 0.33
CRHR1 P34998 2/20 0.31
HDAC1 Q13547 3/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
PTGDR Q13258 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31

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
SCHEMBL965519 1.00 PPARG (0.37) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL965585 0.98 MAPT (0.36) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL965582 0.98 MAPT (0.36) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL4554061 0.94 MAPT (0.38) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL5116549 0.94 MAPT (0.38) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL966906 0.91 MAPT (0.36) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL966907 0.91 MAPT (0.36) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL965508 0.91 MAPT (0.39) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL965506 0.91 MAPT (0.39) PPARGMAPTNR2F2HTTSMN1; SMN2
SCHEMBL965545 0.89 HDAC1 (0.33) MAPTHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US claimed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 US claimed
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 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 (2 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 PPARG 248/4885MAPT 4343/4885NR2F2 2010/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG PPARG 3/4885MAPT 4720/4885NR2F2 201/4885

“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.