SCHEMBL4575407

SCHEMBL4575407

C=CCc1cc(CCN(Cc2ccc(C(F)(F)F)cc2)c2ccc(C)cn2)ccc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.33
GAA P10253 3/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GABRA1 P14867 4/20 0.33
GABRB2 P47870 4/20 0.33
POLB P06746 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
ALOX5 P09917 1/20 0.33
GABRB1 P18505 1/20 0.33
RXRA P19793 1/20 0.33
CNR1 P21554 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
CNR2 P34972 1/20 0.33
GABRA2 P47869 1/20 0.33

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
SCHEMBL4575245 0.88 FFAR4 (0.37) FFAR4GAAKDM4ELMNAHTT
SCHEMBL4574841 0.81 NR1H2 (0.39) GAAKDM4ELMNAHTTSMN1; SMN2
SCHEMBL4575469 0.74 PPARD (0.48)
SCHEMBL4574817 0.72 POLB (0.36) GAAGABRA1GABRB2POLBMAPT
SCHEMBL4575335 0.71 PPARA (0.52)
SCHEMBL14277953 0.70 KDM4E (0.30) GAAKDM4ELMNAHTTSMN1; SMN2
SCHEMBL4575276 0.70 PTGDR2 (0.43) KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL4575413 0.68 ESR1 (0.37) FFAR4GAAKDM4ELMNAHTT
SCHEMBL1400362 0.67 GABRA1 (0.59) GAAKDM4ELMNAHTTNPSR1
SCHEMBL4575226 0.67 CYP19A1 (0.33) GAAKDM4ELMNAHTTSMN1; SMN2

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-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD FFAR4 42/4885GAA 427/4885KDM4E 4112/4885

“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.