SCHEMBL2511599

SCHEMBL2511599

CCCCC(O)C(O)COc1ccc(-c2nc(-c3ccc(C)cc3C)nc(-c3ccc(C)cc3C)n2)c(O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.35
RAB9A P51151 2/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
NFKB1 P19838 1/20 0.35
MAPK1 P28482 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TLR8 Q9NR97 1/20 0.33
LMNA P02545 3/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL537022 0.96 CNR2 (0.34) NPC1RAB9ATP53POLBNFKB1
SCHEMBL1552093 0.96 CNR2 (0.34) NPC1RAB9ATP53POLBNFKB1
SCHEMBL1552126 0.96 CNR2 (0.34) NPC1RAB9ATP53POLBNFKB1
SCHEMBL5563221 0.92 CNR2 (0.32) NPC1RAB9ATP53POLBNFKB1
SCHEMBL4683346 0.90 ALDH1A1 (0.34) NPC1RAB9ATP53MAPK1MAPT
SCHEMBL6228397 0.90 ADRB2 (0.37) NPC1RAB9ATP53POLBNFKB1
SCHEMBL20024340 0.87 LMNA (0.37) NPC1RAB9ATP53POLBNFKB1
SCHEMBL7894750 0.87 LMNA (0.37) NPC1RAB9ATP53POLBNFKB1
SCHEMBL14480155 0.86 PLA2G4B (0.39) NPC1RAB9ATP53POLBNFKB1
SCHEMBL30310082 0.86 PLA2G4B (0.39) NPC1RAB9ATP53POLBNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3044208-B1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2021-12-22 EP disclosed
US-10793555-B2 Oxime ester photoinitiators BASF SE (DE) 2020-10-06 US disclosed
US-20180208583-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2018-07-26 US disclosed
US-8664301-B2 Method for producing a thermoplastic polymer material SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-04 US disclosed
US-8524819-B2 Thermoplastic polymer composition and production method thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-03 US disclosed
EP-2258758-B1 Thermoplastic polymer composition and production method thereof SUMITOMO CHEMICAL CO (JP) 2012-05-09 EP disclosed
US-20110245382-A1 METHOD FOR PRODUCING A THERMOPLASTIC POLYMER MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed
US-20100311883-A1 THERMOPLASTIC POLYMER COMPOSITION AND PRODUCTION METHOD THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-09 US disclosed
EP-2258758-A1 Thermoplastic polymer composition and production method thereof Sumitomo Chemical Company, Limited (JP) 2010-12-08 EP disclosed
US-6084013-A MIXTURES OF SUBSTITUTED URACILS OR THIURACILS WITH ALUMINUM CALCIUM HYDROXIDES, PHOSPHITES AND CARBONATES OR THEIR HYDRATES, ALSO LITHIUM LAYERED LATTICE COMPOUNDS AND TITANIUM HYDROTALCITES, FOR POLYVINYL CHLORIDE WITCO VINYL ADDITIVES GMBH (DE) 2000-07-04 US disclosed
US-6077891-A ADDING TO THERMOPLASTICS POLYFUNCTIONAL EPOXIDE AND STERICALLY HINDERED PHENOL CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-06-20 US disclosed
US-5756793-A CONTAINING BENZOPHENONE DERIVATIVE ULTRAVIOLET LIGHT ABSORBER CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1998-05-26 US disclosed
US-5707690-A CLEAR COAT WITH ULTRAVIOLET RADIATION ABSORBER, HYDROXYBENZOPHENONE DERIVATIVES CIBA-GEIGY CORPORATION (US) 1998-01-13 US disclosed
EP-0702704-A1 STABILIZATION OF DAMAGED THERMOPLASTICS Ciba SC Holding AG (CH) 1996-03-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10793555-B2 Oxime ester photoinitiators NR2E3, OXER1, CBR3 NPC1 3823/4885RAB9A 3515/4885TP53 4385/4885
US-20180208583-A1 OXIME ESTER PHOTOINITIATORS NR2E3, OXER1, CBR3 NPC1 3823/4885RAB9A 3515/4885TP53 4385/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.