SCHEMBL28946510

SCHEMBL28946510

Cc1ccc(OP(=O)(O)O)c(C(C)(C)C)c1.[KH]

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ INPPL1 O15357 11/20 0.44
▸ INPP5A Q14642 6/20 0.44
▸ AKT1 P31749 1/20 0.44
▸ INPP5B P32019 2/20 0.44
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ TYR P14679 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ SRC P12931 2/20 0.37
▸ LMNA P02545 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ MRGPRX4 Q96LA9 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
SCHEMBL2869215 0.98 INPPL1 (0.46) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL27354525 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL27455100 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL27433045 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL27341251 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL27467153 0.95 INPPL1 (0.43) INPPL1INPP5AAKT1INPP5BMEN1
SCHEMBL5085354 0.88 MEN1 (0.39) INPPL1INPP5AMEN1KMT2AALDH1A1
SCHEMBL10717394 0.85 INPPL1 (0.45) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL1487458 0.84 CYP3A4 (0.44) MEN1KMT2AALDH1A1CA2POLB
SCHEMBL27901263 0.83 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BALDH1A1

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
CN-102850577-A Nucleating agent composition and preparation method thereof, and polypropylene material CHINA PETROLEUM & CHEMICAL 2013-01-02 — — CN claimed
CN-102850577-A Nucleating agent composition and preparation method thereof, and polypropylene material CHINA PETROLEUM & CHEMICAL 2013-01-02 — — CN disclosed
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