SCHEMBL11636674

SCHEMBL11636674

CC(=O)Oc1c(C)c(C)nn1Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 18/20 0.49
▸ P2RY14 Q15391 1/20 0.43

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
SCHEMBL11618307 0.84 PTGDR2 (0.41) PTGDR2
SCHEMBL11615839 0.80 PTGDR2 (0.47) PTGDR2
SCHEMBL18483490 0.77 PTGDR2 (0.55) PTGDR2
SCHEMBL11616625 0.74 PTGDR2 (0.41) PTGDR2P2RY14
SCHEMBL11618423 0.74 PTGDR2 (0.44) PTGDR2
SCHEMBL11617121 0.73 PTGDR2 (0.40) PTGDR2
SCHEMBL11611744 0.73 GRN (0.43) —
SCHEMBL31673676 0.73 POLB (0.70) PTGDR2P2RY14
SCHEMBL28785118 0.72 ALDH1A1 (0.41) —
SCHEMBL11613245 0.72 P2RY14 (0.47) PTGDR2P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4117143-A USED AS ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 — — US disclosed
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