SCHEMBL3389210

SCHEMBL3389210

CCC(NC(=O)NCc1ccccc1)c1cc(C)cnc1-c1cc(CC(=O)O)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.45
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
CTSA P10619 2/20 0.39
PPARA Q07869 2/20 0.39
PPARG P37231 1/20 0.39
PTPN1 P18031 1/20 0.38
PPARD Q03181 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL3391149 0.93 L3MBTL1 (0.40) PTGDR2L3MBTL1ATMPPARAPPARG
SCHEMBL152640 0.84 PTGDR2 (0.47) PTGDR2L3MBTL1ATMPPARAPPARG
SCHEMBL153846 0.81 PTGDR2 (0.47) PTGDR2L3MBTL1PPARAPPARGPTPN1
SCHEMBL140878 0.80 PTGDR2 (0.51) PTGDR2
SCHEMBL151441 0.79 PTGDR2 (0.46) PTGDR2
SCHEMBL150878 0.78 PTGDR2 (0.60) PTGDR2PPARAPPARG
SCHEMBL138451 0.78 PTGDR2 (0.62) PTGDR2
SCHEMBL3387640 0.78 PTGDR2 (0.47) PTGDR2ATMPPARAPPARGPTPN1
SCHEMBL149940 0.77 L3MBTL1 (0.45) PTGDR2L3MBTL1ATMPPARAPPARG
SCHEMBL153725 0.77 PTGDR2 (0.53) PTGDR2MAPK1

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
US-8378107-B2 Heteroaryl antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-02-19 US claimed
US-20110319445-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-12-29 US claimed
WO-2010039977-A2 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-04-08 WO claimed
US-8378107-B2 Heteroaryl antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-02-19 US disclosed
US-20110319445-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-12-29 US disclosed
WO-2010039977-A2 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-04-08 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-20110319445-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885L3MBTL1 3778/4885ATM 4310/4885

“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.