SCHEMBL697364

SCHEMBL697364

CCc1cc(OCc2ccccc2)c(F)c(CC)c1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK14 Q16539 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.41
ERN1 O75460 2/20 0.40
CCNB2 O95067 1/20 0.40
CDK1 P06493 1/20 0.40
CDK4 P11802 1/20 0.40
CCNB1 P14635 1/20 0.40
CCND1 P24385 1/20 0.40
CCNB3 Q8WWL7 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39

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
SCHEMBL954841 0.81 NPC1 (0.54) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL8761770 0.80 MAPT (0.49) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL8819753 0.78 VEGFA (0.42) NPC1RAB9AMAPTL3MBTL1MAPK14
SCHEMBL8762055 0.78 MAPK14 (0.41) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL18526976 0.77 NPC1 (0.52) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL1841867 0.77 L3MBTL1 (0.49) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL955846 0.76 MAOB (0.54) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL698534 0.76 MAPT (0.48) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL8761568 0.75 L3MBTL1 (0.45) NPC1RAB9AMAPTL3MBTL1SMN1; SMN2
SCHEMBL8761806 0.75 MAPT (0.47) NPC1RAB9AMAPTL3MBTL1SMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791266-B2 Thyroid hormone β receptor agonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-07-29 US disclosed
US-8791266-B2 Thyroid hormone β receptor agonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-07-29 US disclosed
US-8791266-B2 Thyroid hormone β receptor agonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-07-29 US disclosed
US-8748620-B2 2014-06-10 US disclosed
US-8748620-B2 2014-06-10 US disclosed
US-8748620-B2 2014-06-10 US disclosed
EP-2423194-B1 NOVEL THYROID HORMONE BETA RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORP (JP) 2014-04-16 EP disclosed
US-20120129812-A1 NOVEL THYROID HORMONE BETA RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-24 US disclosed
US-20120129812-A1 NOVEL THYROID HORMONE BETA RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-24 US disclosed
US-20120129812-A1 NOVEL THYROID HORMONE BETA RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-24 US disclosed
EP-2423194-A1 NOVEL THYROID HORMONE beta RECEPTOR AGONIST Mitsubishi Tanabe Pharma Corporation (JP) 2012-02-29 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-20120129812-A1 NOVEL THYROID HORMONE BETA RECEPTOR AGONIST THRB, TSHR, THRA NPC1 2579/4885RAB9A 1368/4885MAPT 2650/4885

“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.