SCHEMBL6525869

SCHEMBL6525869

Cc1ccc(C2C=CC(c3ccc(C)cc3)C=C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
MAPT P10636 2/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
TNKS2 Q9H2K2 1/20 0.36
TSHR P16473 4/20 0.36
LMNA P02545 2/20 0.36
ALOX12 P18054 1/20 0.35

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
SCHEMBL4349198 0.82 MAPT (0.39) ACHETDP1MEN1KMT2AALDH1A1
SCHEMBL21579390 0.80 MEN1 (0.41) ACHETDP1MEN1KMT2AALDH1A1
SCHEMBL21161987 0.75 ACHE (0.42) ACHETDP1MEN1KMT2AALDH1A1
P-Xylene SCHEMBL11772917 0.71 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL460348 0.71 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL771 0.71
P-Xylene SCHEMBL11770184 0.71 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
SCHEMBL2719092 0.69 MEN1 (0.50) ACHEMEN1KMT2AALDH1A1CA1
SCHEMBL10801414 0.67 MAPT (0.64) ACHETDP1MEN1KMT2AALDH1A1
SCHEMBL1405569 0.67 ESR2 (0.50) ACHETDP1ALDH1A1MAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed