SCHEMBL6914355

SCHEMBL6914355

CCO[PH](=O)OCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.[CaH2]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.46
ALDH1A1 P00352 7/20 0.43
KMT2A Q03164 4/20 0.43
TSHR P16473 3/20 0.43
MAPK1 P28482 3/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
BLM P54132 2/20 0.43
ATM Q13315 2/20 0.43
HIF1A Q16665 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
USP2 O75604 1/20 0.43
CYP2D6 P10635 1/20 0.43
GAA P10253 6/20 0.42
LMNA P02545 3/20 0.42
GMNN O75496 1/20 0.41
GABBR2 O75899 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL2441451 1.00 HMGCR (0.46) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL1338531 0.98 HMGCR (0.47) HMGCRALDH1A1KMT2ATSHRMAPK1
Calcium SCHEMBL29534797 0.97 HMGCR (0.46) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL5168179 0.97 HMGCR (0.46) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL8859191 0.94 ALDH1A1 (0.47) HMGCRALDH1A1KMT2ATSHRMAPK1
Butane SCHEMBL23111309 0.92 ALDH1A1 (0.44) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL551093 0.92 ALDH1A1 (0.49) HMGCRALDH1A1KMT2ATSHRMAPK1
Calcium SCHEMBL29658113 0.91 ALDH1A1 (0.47) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL10748334 0.83 ALDH1A1 (0.44) HMGCRALDH1A1KMT2ATSHRMAPK1
SCHEMBL27925238 0.83 ALDH1A1 (0.46) HMGCRALDH1A1KMT2ATSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117264175-A Polyisocyanate composition, aqueous coating composition, coated substrate, and method for producing polyisocyanate composition 旭化成株式会社 2023-12-22 CN disclosed
US-6762226-B2 PHOTOSTABILITY; HEAT AND OXIDATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION 2004-07-13 US disclosed
US-20030139500-A1 Compositions stabilized by dioxopiperazinyl derivatives ZEDDA ALESSANDRO (IT) 2003-07-24 US disclosed
EP-1185577-B1 POLYSILANE STABILIZERS CONTAINING STERICALLY HINDERED AMINE GROUPS CIBA SC HOLDING AG (CH) 2003-05-21 EP disclosed
US-6538055-B1 2,2,6,6-Tetramethylpiperidinyl substituents; oxidation, radiation and heat resistance CIBA SPECIALTY CHEMICALS CORPORATION 2003-03-25 US disclosed
US-20020086921-A1 Compositions stabilized by dioxopiperazinyl derivatives ZEDDA ALESSANDRO (IT) 2002-07-04 US disclosed
EP-1185577-A1 POLYSILANE STABILIZERS CONTAINING STERICALLY HINDERED AMINE GROUPS Ciba SC Holding AG (CH) 2002-03-13 EP disclosed
WO-2000064965-A1 POLYSILANE STABILIZERS CONTAINING STERICALLY HINDERED AMINE GROUPS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-11-02 WO disclosed
US-5948836-A STERICALLY HINDERED HYDROXYLAMINE ETHER; METAL OXIDE OR HYDROXIDE, AGRICULTURAL USE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-07 US disclosed