SCHEMBL7903658

SCHEMBL7903658

CC1=CCC(C2c3ccccc3-c3ccccc32)=C1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
HTR2A P28223 2/20 0.32
GPR3 P46089 1/20 0.32
EPHX2 P34913 1/20 0.31
ADRA2C P18825 1/20 0.30
PTGS2 P35354 1/20 0.30
HRH1 P35367 1/20 0.30
HTR3A P46098 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL5084805 0.69 MEN1 (0.41) MEN1POLBKMT2AATMGPR3
SCHEMBL28856362 0.67 GABRA1 (0.41) SLC6A2SLC6A4SLC6A3MEN1POLB
Hydrochloric Acid SCHEMBL7941237 0.64 EPHX2 (0.32) POLBEPHX2
Hydrochloric Acid SCHEMBL946385 0.62 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3MEN1POLB
SCHEMBL10436063 0.62 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3POLBHTR2A
SCHEMBL7903698 0.62 POLB (0.35) POLBEPHX2
SCHEMBL6677712 0.61 GPR3 (0.32) GPR3
SCHEMBL9018607 0.61 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3MEN1POLB
Hydrochloric Acid SCHEMBL7553837 0.61 GPR3 (0.32) GPR3
SCHEMBL9703896 0.61 EPHX2 (0.39) SLC6A2SLC6A4SLC6A3HTR2AGPR3

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-6225425-B1 SUSPENSION OR GAS PHASE POLYMERIZATION OF PROPYLENE OR CYCLIC OLEFIN IN PRESENCE OF CATALYST COMPRISING METALLOCENE AND ALUMINOXANE TARGOR GMBH (DE) 2001-05-01 US disclosed
US-6197902-B1 Syndio-isoblock polymer and process for its preparation TARGOR GMBH (DE) 2001-03-06 US disclosed
EP-0399347-B1 Process for preparing a Syndio-isoblockpolymer HOECHST AG (DE) 1996-08-14 EP disclosed