SCHEMBL9568092

SCHEMBL9568092

O=C(NCC(c1ccccc1)c1ccccc1)C1CCc2ccccc2C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.49
P2RX7 Q99572 1/20 0.46
NPY5R Q15761 3/20 0.46
GBA1 P04062 1/20 0.45
POLB P06746 1/20 0.45
PLD2 O14939 1/20 0.44
PLD1 Q13393 1/20 0.44
EPHX2 P34913 1/20 0.44
CXCR3 P49682 1/20 0.43
REN P00797 1/20 0.42
MTNR1A P48039 3/20 0.42
MTNR1B P49286 3/20 0.42
F2 P00734 1/20 0.42
FAAH O00519 2/20 0.41
TAAR1 Q96RJ0 1/20 0.41

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
SCHEMBL9046598 0.83 POLB (0.41) GHSRP2RX7NPY5RPOLBPLD2
SCHEMBL9046604 0.80 PTGIR (0.63)
SCHEMBL9567957 0.80 LMNA (0.63) GHSRP2RX7MTNR1AMTNR1BFAAH
SCHEMBL9083616 0.78 GRIN2B (0.56) NPY5RPOLBTAAR1
SCHEMBL9568170 0.77 P2RX7 (0.45) GHSRP2RX7NPY5RGBA1PLD2
SCHEMBL366547 0.76 P2RX7 (0.55) GHSRP2RX7NPY5RGBA1MTNR1A
SCHEMBL6642213 0.75 GHSR (0.69) GHSRP2RX7POLB
SCHEMBL30982230 0.75 CYP2D6 (0.46) POLBTAAR1
SCHEMBL6584070 0.74 P2RX7 (0.53) GHSRP2RX7NPY5RMTNR1AMTNR1B
SCHEMBL6584064 0.74 P2RX7 (0.53) GHSRP2RX7NPY5RMTNR1AMTNR1B

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