SCHEMBL349147

SCHEMBL349147

COC(=O)Cc1ccc(OC(F)F)c(Oc2ccc(NC(=O)C(C)(C)C)cc2CSCC(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.56
LMNA P02545 6/20 0.38
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
MAPT P10636 6/20 0.38
ALDH1A1 P00352 3/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GNRHR P30968 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 3/20 0.32
GAA P10253 1/20 0.32
GFER P55789 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL350059 0.92 CYP3A4 (0.64) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL349133 0.90 CYP3A4 (0.55) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL348007 0.90 CYP3A4 (0.55) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL347052 0.87 CYP3A4 (0.53) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL13521976 0.87 CYP3A4 (0.53) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL347667 0.85 CYP3A4 (0.62) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL349844 0.85 CYP3A4 (0.77) CYP3A4MAPTALDH1A1CYP1A2CYP2C9
SCHEMBL349488 0.85 GAA (0.39) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL12409579 0.83 CYP3A4 (0.36) CYP3A4LMNAMEN1KMT2AMAPT
SCHEMBL16510019 0.82 CYP3A4 (0.56) CYP3A4LMNAKMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247602-B2 Antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2012-08-21 US disclosed
US-20120016029-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PANMIRA PHARMACEUTICALS, LLC (US) 2012-01-19 US disclosed
US-8071807-B2 Antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2011-12-06 US disclosed
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors AMIRA PHARMACEUTICALS, INC. (US) 2011-08-04 US disclosed
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors AMIRA PHARMACEUTICALS, INC. (US) 2011-08-04 US disclosed
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors AMIRA PHARMACEUTICALS, INC. (US) 2011-08-04 US disclosed
US-20110144160-A1 Antagonists of Prostaglandin D2 Receptors AMIRA PHARMACEUTICALS, INC. (US) 2011-06-16 US disclosed
US-20100004331-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-01-07 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 (4 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-20120016029-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 CYP3A4 1441/4885LMNA 2277/4885MEN1 4751/4885
US-20100004331-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 CYP3A4 1441/4885LMNA 2277/4885MEN1 4751/4885
US-20110144160-A1 Antagonists of Prostaglandin D2 Receptors PTGDR, PTGDR2, PTGER2 CYP3A4 1441/4885LMNA 2277/4885MEN1 4751/4885
US-20110190227-A1 Antagonists of Prostaglandin D2 Receptors PTGDR, PTGDR2, PTGER2 CYP3A4 1367/4885LMNA 2161/4885MEN1 4760/4885

“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.