SCHEMBL1801563

SCHEMBL1801563

CCc1ccc(N(CC)C(=O)[C@H]2C[C@H](C)N(C(=O)c3ccc(OC)cc3)c3ccccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 16/20 0.57
P2RY1 P47900 2/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL1801564 1.00 PTGDR2 (0.57) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1799871 0.95 PTGDR2 (0.59) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1799873 0.95 PTGDR2 (0.59) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1799875 0.95 PTGDR2 (0.59) PTGDR2P2RY1MEN1KMT2A
SCHEMBL12617600 0.93 PTGDR2 (0.54) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1801602 0.93 PTGDR2 (0.54) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1801604 0.93 PTGDR2 (0.54) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1799086 0.93 PTGDR2 (0.63) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1801326 0.93 PTGDR2 (0.63) PTGDR2P2RY1MEN1KMT2A
SCHEMBL1799087 0.93 PTGDR2 (0.63) PTGDR2P2RY1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951950-B2 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-31 US disclosed
US-7951950-B2 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-31 US disclosed
US-7951950-B2 PGD2 receptor antagonists for the treatment of inflammatory diseases MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-31 US disclosed
US-20060241109-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-26 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-20060241109-A1 PGD2 receptor antagonists for the treatment of inflammatory diseases PTGER2, PTGDR2, PTGER1 PTGDR2 2/4885P2RY1 174/4885MEN1 4590/4885

“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.