SCHEMBL1426490

SCHEMBL1426490

Cc1ccc(OP(=O)(O[S])Oc2ccc(C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ USP2 O75604 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ CA2 P00918 2/20 0.32
▸ ACHE P22303 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TYR P14679 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL1487458 0.90 CYP3A4 (0.44) CYP3A4MEN1KMT2ATSHRUSP2
SCHEMBL1426519 0.84 CA1 (0.38) ALDH1A1CA2SMN1; SMN2MAPK1TDP1
SCHEMBL1465540 0.81 MEN1 (0.41) MEN1KMT2ATSHRUSP2LMNA
SCHEMBL1427028 0.80 HMGCR (0.33) MEN1KMT2APOLBSMN1; SMN2PTGDR2
SCHEMBL27890628 0.80 MEN1 (0.36) CYP3A4MEN1KMT2ATSHRUSP2
SCHEMBL5085354 0.80 MEN1 (0.39) CYP3A4MEN1KMT2ATSHRUSP2
SCHEMBL2869215 0.80 INPPL1 (0.46) MEN1KMT2AUSP2LMNAALDH1A1
SCHEMBL28946510 0.79 INPPL1 (0.44) MEN1KMT2AUSP2LMNAALDH1A1
SCHEMBL30400548 0.79 GPR84 (0.38) CYP3A4MEN1KMT2ATSHRUSP2
Lithium Ion SCHEMBL27874331 0.79 MEN1 (0.36) CYP3A4MEN1KMT2ATSHRUSP2

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
EP-2300523-A1 POLYOLEFIN COMPOSITION WITH LOW CLTE Borealis AG (AT) 2011-03-30 — — EP disclosed
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