SCHEMBL10899765

SCHEMBL10899765

CC(SCc1ccccc1)SCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
TAAR1 Q96RJ0 3/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
MAOA P21397 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
PRMT1 Q99873 1/20 0.42

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
SCHEMBL560907 0.85 PPARG (0.45) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL10585977 0.81 NPSR1 (0.47) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL1467047 0.81 SLC6A2 (0.52) PPARGPPARATAAR1SLC6A2SLC6A4
SCHEMBL27690898 0.81 PPARG (0.42) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL7215558 0.81 PPARG (0.42) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL24013069 0.81 IDO1 (0.43) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL4850434 0.81 PPARG (0.42) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL2878611 0.79 L3MBTL1 (0.42) L3MBTL1ATMNPSR1PPARGPPARA
SCHEMBL17251292 0.79 L3MBTL1 (0.42) L3MBTL1ATMPPARGPPARATAAR1
Hydrochloric Acid SCHEMBL1466263 0.79 SLC6A2 (0.50) PPARGPPARATAAR1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4476326-A ORGANOSULFUR COMPOUND, ORGANONITROGEN COMPOUND WITH COBALT IODIDE, OR 1,1-BIS(DIPHENYLPHOSPHINO) FERROCENE TEXACO INC. (US) 1984-10-09 US claimed
EP-0175797-A1 A process for the synthesis of ethanol and acetaldehyde using cobalt compounds with novel promoters TEXACO DEVELOPMENT CORPORATION (US) 1986-04-02 EP disclosed
US-4476326-A ORGANOSULFUR COMPOUND, ORGANONITROGEN COMPOUND WITH COBALT IODIDE, OR 1,1-BIS(DIPHENYLPHOSPHINO) FERROCENE TEXACO INC. (US) 1984-10-09 US disclosed