SCHEMBL9870880

SCHEMBL9870880

C[C@@H](C[C@H](C)Oc1ccc(Cl)cc1)Oc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
P2RX3 P56373 1/20 0.42
PPARG P37231 6/20 0.42
PPARA Q07869 6/20 0.42
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC6A4 P31645 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
SCHEMBL9191274 0.84 SIGMAR1 (0.49) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL1838537 0.83 SIGMAR1 (0.51) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL8767214 0.83 SIGMAR1 (0.49) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL9358146 0.83 SIGMAR1 (0.51) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL10900497 0.83 SIGMAR1 (0.47) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL23046356 0.83 SIGMAR1 (0.51) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL1830811 0.82 SIGMAR1 (0.44) SIGMAR1POLBL3MBTL1PPARGPPARA
SCHEMBL8421896 0.79 SIGMAR1 (0.45) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL11614077 0.79 SIGMAR1 (0.50) SIGMAR1POLBL3MBTL1P2RX3PPARG
SCHEMBL28546232 0.79 SIGMAR1 (0.45) SIGMAR1POLBL3MBTL1P2RX3PPARG

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-5043094-A Optically active bisaryl compound ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1991-08-27 US disclosed