SCHEMBL8410977

SCHEMBL8410977

CC(=O)Oc1cccc2c1CCC(Cc1cc(C(c3ccccc3)c3ccccc3)ns1)C2

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 16/20 0.48
TBXAS1 P24557 2/20 0.42
CYP19A1 P11511 1/20 0.40
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37

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
SCHEMBL8410886 0.88 CYP19A1 (0.53) PTGIRCYP19A1
SCHEMBL8410974 0.88 PTGIR (0.63) PTGIRTBXAS1
SCHEMBL8414344 0.84 PTGIR (0.48) PTGIRTBXAS1CYP19A1MTNR1AMTNR1B
SCHEMBL8410999 0.83 CYP19A1 (0.50) PTGIRCYP19A1
SCHEMBL8412761 0.82 PTGIR (0.48) PTGIRTBXAS1CYP19A1MTNR1AMTNR1B
SCHEMBL8411141 0.82 PTGIR (0.46) PTGIRTBXAS1CYP19A1MTNR1AMTNR1B
SCHEMBL8410707 0.79 PTGIR (0.45) PTGIRTBXAS1CYP19A1
SCHEMBL8413614 0.79 PTGIR (0.45) PTGIRTBXAS1CYP19A1MTNR1AMTNR1B
SCHEMBL8413478 0.78 PTGIR (0.44) PTGIRTBXAS1CYP19A1
SCHEMBL8414340 0.78 PTGIR (0.57) PTGIRTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962439-A CARDIOVASCULAR DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US claimed
EP-0548949-B1 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO (JP) 1997-09-17 EP claimed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP claimed
US-5962439-A CARDIOVASCULAR DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5849919-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor anonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed