SCHEMBL10102080

SCHEMBL10102080

C/C(=N\OCc1cccc(OC(F)(F)F)c1F)c1ccc(C)c(O)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 7/20 0.37
LMNA P02545 1/20 0.36
PTBP1 P26599 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPARG P37231 7/20 0.35
PPARA Q07869 7/20 0.35
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
GRIN2B Q13224 1/20 0.33
PPARD Q03181 2/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
KDM2B Q8NHM5 1/20 0.33
PHF8 Q9UPP1 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
SCHEMBL10107038 0.88 NR1H4 (0.40) NR1H4LMNAPTBP1SMN1; SMN2PPARG
SCHEMBL10101749 0.79 MAOB (0.42) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL15255331 0.78 NPC1 (0.42) SMN1; SMN2PPARGPPARAGRIN2BMRGPRX4
SCHEMBL10102074 0.76 MAOB (0.45) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL10102038 0.74 SMN1; SMN2 (0.51) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL10101744 0.74 S1PR1 (0.41) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL10102011 0.74 NPC1 (0.46) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL12557400 0.72 PPARG (0.41) NR1H4SMN1; SMN2PPARGPPARAS1PR1
SCHEMBL10102056 0.72 SMN1; SMN2 (0.44) LMNAPTBP1SMN1; SMN2PPARGPPARA
SCHEMBL10102036 0.71 NPC1 (0.50) LMNASMN1; SMN2PPARGPPARAS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046255-A1 NON-STEROIDAL COMPOUNDS THE UNIVERSITY OF MELBOURNE of ROYAL PARADE PARKVILLE (AU) 2012-02-23 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 (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-20120046255-A1 NON-STEROIDAL COMPOUNDS PTGES2, PTGES, PTGES3 NR1H4 27/4885LMNA 2636/4885PTBP1 2831/4885

“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.