SCHEMBL2829264

SCHEMBL2829264

CC(C)c1cc(-c2cc(C(C)C)c(OCCC3CO3)c(C(C)C)c2)cc(C(C)C)c1OCCC1CO1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.37
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL2832835 0.92 SRD5A2 (0.36) SRD5A2CA1CA2MEN1KMT2A
SCHEMBL2831550 0.91 ALDH1A1 (0.37) SRD5A2CA1CA2MEN1KMT2A
SCHEMBL2835818 0.88 MEN1 (0.37) MEN1KMT2A
SCHEMBL2833181 0.88 MEN1 (0.34) MEN1KMT2A
SCHEMBL2831476 0.85 MEN1 (0.40) MEN1KMT2AALDH1A1TP53TSHR
SCHEMBL2836085 0.83 ALDH1A1 (0.43) SRD5A2CA1CA2MEN1KMT2A
SCHEMBL2832845 0.83 TSHR (0.41) SRD5A2CA1CA2MEN1KMT2A
SCHEMBL2833175 0.80 MEN1 (0.36) MEN1KMT2AALDH1A1
SCHEMBL2832687 0.80 MEN1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL2832887 0.80 ALDH1A1 (0.36) MEN1KMT2AALDH1A1TP53CYP3A4

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-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed