SCHEMBL11600712

SCHEMBL11600712

CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].C[Sn+2]Cl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
BHMT Q93088 2/20 0.36
GPR84 Q9NQS5 1/20 0.35
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
NFKB1 P19838 1/20 0.33
BBOX1 O75936 2/20 0.33
CA2 P00918 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
SCHEMBL748704 0.94 CA1 (0.47) CA1BHMTGPR84KDM4CKDM4A
SCHEMBL10592362 0.90 CA1 (0.50) CA1BHMTGPR84KDM4CKDM4A
SCHEMBL17472939 0.90 CA1 (0.50) CA1BHMTGPR84KDM4CKDM4A
SCHEMBL8998738 0.86 GPR84 (0.39) CA1BHMTGPR84NFKB1CA2
SCHEMBL8501640 0.82 GPR84 (0.41) CA1BHMTGPR84NFKB1CA2
SCHEMBL3715599 0.81 GPR84 (0.42) CA1BHMTGPR84NFKB1CA2
SCHEMBL2934241 0.79 CA1 (0.39) CA1GPR84KDM4CKDM4APHF8
SCHEMBL11317308 0.76 CA1 (0.37) CA1BHMTGPR84BBOX1
SCHEMBL24488109 0.76 BHMT (0.42) CA1BHMTKDM4CKDM4APHF8
SCHEMBL9777669 0.76 BHMT (0.54) BHMTKDM4CKDM4APHF8KDM2A

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-4120845-A FOR VINYL OR VINYLIDENE HALIDE POLYMERS CINCINNATI MILACRON CHEMICALS, INC. (US) 1978-10-17 US disclosed
US-4062881-A POLYVINYL CHLORIDE CINCINNATI MILACRON CHEMICALS, INC. (US) 1977-12-13 US disclosed