SCHEMBL9567951

SCHEMBL9567951

CONC(=O)C(c1ccccc1)(c1ccccc1)C1CCc2ccccc2C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.42
MTNR1B P49286 7/20 0.42
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
NPY5R Q15761 1/20 0.37
PLAU P00749 1/20 0.36
GHSR Q92847 1/20 0.36
KCNN4 O15554 1/20 0.36
ANPEP P15144 1/20 0.35
ACHE P22303 2/20 0.35
ADORA2A P29274 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34

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
SCHEMBL9568069 0.85 MTNR1A (0.44) MTNR1AMTNR1BCA1CA2NPY5R
SCHEMBL9047661 0.81 PTGIR (0.53)
SCHEMBL9567991 0.80 PIN1 (0.40) MTNR1AMTNR1BCA1CA2
SCHEMBL9567983 0.75 MAPK1 (0.44)
SCHEMBL9049212 0.71 PTGIR (0.54)
SCHEMBL10062425 0.70 PLAU (0.46) MTNR1AMTNR1BCA1CA2PLAU
SCHEMBL28615437 0.67 KCNN4 (0.62) KCNN4
SCHEMBL18984385 0.67 MTNR1A (0.44) MTNR1AMTNR1BCA1CA2NPY5R
SCHEMBL4447296 0.66 HDAC3 (0.63) KCNN4
SCHEMBL28627442 0.66 MAPT (0.57) KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP claimed
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP disclosed