SCHEMBL5881695

SCHEMBL5881695

CCCCS(=O)(=O)NC(=O)c1ccc2[nH]c(C)c(Cc3ccc(Cl)cc3Cl)c2c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.51
SIRT1 Q96EB6 2/20 0.40
SNCA P37840 1/20 0.40
CNR1 P21554 1/20 0.39
MCL1 Q07820 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PTGS2 P35354 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL5881578 0.97 PPARG (0.55) PPARGSIRT1SNCACNR1MCL1
SCHEMBL5881907 0.96 PPARG (0.54) PPARGSIRT1SNCACNR1MCL1
SCHEMBL5881789 0.96 PPARG (0.54) PPARGSIRT1SNCACNR1MCL1
SCHEMBL5881856 0.94 PPARG (0.47) PPARGSIRT1SNCACNR1MCL1
SCHEMBL5882237 0.93 PPARG (0.47) PPARGSNCAMCL1MAPTL3MBTL1
SCHEMBL5882877 0.93 PPARG (0.51) PPARGMCL1PTGS2
SCHEMBL5881939 0.89 PTPN5 (0.43) PPARGSNCAMCL1MAPTL3MBTL1
SCHEMBL6320738 0.89 PPARG (0.46) PPARGSIRT1CNR1MAPTKDM4E
SCHEMBL5882099 0.89 PPARG (0.46) PPARGCNR1MCL1MAPTCYP1A2
SCHEMBL5881878 0.88 PPARG (0.41) PPARGSNCAMCL1MAPTL3MBTL1

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-7115647-B2 Method of inhibiting neoplastic cells with indole derivatives OSI PHARMACEUTICALS, INC. (US) 2006-10-03 US disclosed
US-20020143022-A1 Method of inhibiting neoplastic cells with indole derivatives OSI PHARMACEUTICALS, INC. 2002-10-03 US disclosed
US-6410584-B1 ANTICANCER AGENTS CELL PATHWAYS, INC. 2002-06-25 US disclosed
EP-1132087-A1 REMEDIES FOR POLYCYSTIC OVARY SYNDROME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-12 EP 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-20020143022-A1 Method of inhibiting neoplastic cells with indole derivatives IDO1, IDO2, INMT PPARG 4239/4885SIRT1 2603/4885SNCA 930/4885

“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.