SCHEMBL1160138

SCHEMBL1160138

CCC(C)(C)c1cc(C(C)(C)CC)c(OP(Oc2cc(C)c(C(C)(C)CC)cc2C(C)(C)CC)Oc2cc(C)c(C(C)(C)CC)cc2C(C)(C)CC)cc1C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.35
▸ NPSR1 Q6W5P4 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ UBE2N P61088 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ APAF1 O14727 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ RAD52 P43351 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NOD2 Q9HC29 1/20 0.32
▸ MITF O75030 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
SCHEMBL1160098 0.77 MAPK1 (0.43) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29373209 0.77 ALOX15 (0.34) SMN1; SMN2ALDH1A1MAPT
SCHEMBL406816 0.77 ALOX15 (0.34) SMN1; SMN2ALDH1A1MAPT
SCHEMBL11181455 0.77 CNR2 (0.39) —
SCHEMBL11177244 0.77 CNR2 (0.39) —
SCHEMBL9175345 0.76 MAPK1 (0.37) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL30770673 0.76 LMNA (0.33) SMN1; SMN2ALDH1A1
SCHEMBL133717 0.74 MAPK1 (0.54) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL1159633 0.74 CASP1 (0.38) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29443083 0.74 MAPK1 (0.54) MAPK1NPSR1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183311-B2 Liquid phosphite composition derived from cresols CHEMTURA CORPORATION (US) 2012-05-22 — — US claimed
WO-2011014211-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS CHEMTURA CORPORATION (US) 2011-02-03 — — WO claimed
US-20100076125-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS CHEMTURA CORPORATION (US) 2010-03-25 — — US claimed
US-8183311-B2 Liquid phosphite composition derived from cresols CHEMTURA CORPORATION (US) 2012-05-22 — — US disclosed
WO-2011014211-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS CHEMTURA CORPORATION (US) 2011-02-03 — — WO disclosed
US-20100076125-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS CHEMTURA CORPORATION (US) 2010-03-25 — — US disclosed
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