SCHEMBL201800

SCHEMBL201800

Cc1ccc(-c2nc(CCOc3ccc(F)c(C(N)=O)c3F)c(C)o2)cc1.NC(=O)c1c(F)ccc(OCc2cccc([N+](=O)[O-])c2)c1F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.44
PPARA Q07869 15/20 0.42
PPARD Q03181 3/20 0.42
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
CYP2C9 P11712 1/20 0.39
KCNH2 Q12809 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 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
SCHEMBL2706705 0.85 PPARA (0.48) PPARGPPARAPPARD
SCHEMBL2706681 0.81 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL31609761 0.80 MEN1 (0.49) MEN1KMT2ALMNA
SCHEMBL2706702 0.80 MEN1 (0.49) MEN1KMT2ALMNA
SCHEMBL202033 0.75 PPARG (0.51) PPARGPPARALMNA
SCHEMBL200994 0.74 PPARG (0.54) PPARGPPARA
SCHEMBL202507 0.73 MRGPRX4 (0.53) LMNA
SCHEMBL201335 0.70 L3MBTL1 (0.64) MEN1KMT2ALMNA
SCHEMBL202627 0.69 MAOB (0.56) MEN1KMT2ALMNA
SCHEMBL10367150 0.69 PPARG (0.64) PPARGPPARAPPARDPTPN2PTPN1

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-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 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-20120122918-A1 ANTIBACTERIAL AGENTS ALK, ROS1, ARG1 PPARG 3846/4885PPARA 2979/4885PPARD 3683/4885
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 PPARG 3402/4885PPARA 3049/4885PPARD 3689/4885

“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.