SCHEMBL2694697

SCHEMBL2694697

CCCC[Sn](CCCC)(Oc1ccccc1C(CC)CC)Oc1ccccc1C(CC)CC

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
CYSLTR2 Q9NS75 2/20 0.32
CYSLTR1 Q9Y271 2/20 0.32
DHFR P00374 1/20 0.31
EGFR P00533 1/20 0.31
PPARG P37231 2/20 0.31
ATM Q13315 1/20 0.30
TSHR P16473 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL2696834 0.94 CYSLTR2 (0.35) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL2696730 0.92 DHFR (0.33) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL2697175 0.87 PPARG (0.35) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL2697634 0.86 KDM4E (0.44) CYP1A2CYP2C9CYP2C19L3MBTL1HTT
SCHEMBL2694306 0.85 CYP1A2 (0.39) CYP1A2CYP2C9CYP2C19L3MBTL1MEN1
SCHEMBL2697117 0.83 CYP1A2 (0.32) CYP1A2CYP2C9CYP2C19L3MBTL1KDM4E
SCHEMBL2695744 0.81 KDM4E (0.35) CYP1A2CYP2C9CYP2C19L3MBTL1HTT
SCHEMBL2694699 0.81 KDM4E (0.35) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL2695767 0.80 KDM4E (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1HTT
SCHEMBL2694389 0.79 SOAT1 (0.41) CYP1A2CYP2C9CYP2C19L3MBTL1MEN1

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-8168812-B2 Process for producing alkyl tin alkoxide compound and process for producing carbonic acid ester using said compound ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-05-01 US disclosed