SCHEMBL706406

SCHEMBL706406

[CH2]Oc1ccc(C(F)(F)F)cn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HPGD P15428 1/20 0.49
THRB P10828 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPK1 P28482 1/20 0.46
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.45
LIPE Q05469 6/20 0.44
BCHE P06276 1/20 0.43
RAB9A P51151 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL1995774 0.80 HPGD (0.50) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL706407 0.79 TSHR (0.63) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL30980818 0.79 TSHR (0.63) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL14523045 0.79 KMT2A (0.51) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL19956152 0.79 KMT2A (0.51) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL8989513 0.79 KMT2A (0.56) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL13064450 0.79 KMT2A (0.47) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL11351938 0.78 MAPT (0.69) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL2737128 0.76 TSHR (0.51) KMT2ATSHRSMN1; SMN2HPGDTHRB
SCHEMBL3370461 0.76 HPGD (0.67) KMT2ATSHRSMN1; SMN2HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280970-B1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2014-01-08 EP disclosed
US-8124636-B2 Imidazolidinone derivatives as 11B-HSD1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-02-28 US disclosed
EP-2280970-A1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS F. Hoffmann-La Roche AG (CH) 2011-02-09 EP disclosed
WO-2009132986-A1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-11-05 WO disclosed
US-20090275573-A1 Imidazolidinone Derivatives as 11B-HSD1 Inhibitors HOFFMANN-LA ROCHE, INC. 2009-11-05 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 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-20090275573-A1 Imidazolidinone Derivatives as 11B-HSD1 Inhibitors HSD11B1, HSD17B1, HSD17B11 KMT2A 2297/4885TSHR 1734/4885SMN1; SMN2 2224/4885

“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.