SCHEMBL4801541

SCHEMBL4801541

CCC1(C)CC(O)C(C)C(C)(CC)N1OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.35
DHFR P00374 3/20 0.34
POLB P06746 1/20 0.32
HTR2C P28335 1/20 0.32
TSHR P16473 1/20 0.32
OPRM1 P35372 4/20 0.32
OPRD1 P41143 3/20 0.32
OPRK1 P41145 3/20 0.32
SIGMAR1 Q99720 3/20 0.31
TMEM97 Q5BJF2 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL886984 0.78 ALOX15 (0.33) MAPTOPRM1OPRD1SIGMAR1MEN1
SCHEMBL10708711 0.78 MAPT (0.43) MAPTOPRM1OPRD1OPRK1SIGMAR1
SCHEMBL14306942 0.75
SCHEMBL4801538 0.75 ALDH1A1 (0.43) ALDH1A1DHFRHTR2CTSHROPRM1
SCHEMBL3388230 0.71 NPC1 (0.39) ALDH1A1MAPTDHFRTSHR
SCHEMBL13006966 0.71 NPC1 (0.39) ALDH1A1MAPTDHFRTSHR
SCHEMBL5062027 0.71 ALDH1A1 (0.45) ALDH1A1MAPTDHFRHTR2CTSHR
SCHEMBL6284322 0.71 CTSL (0.38) ALDH1A1MAPTOPRM1
SCHEMBL6284323 0.71 CTSL (0.36) MAPTPOLBOPRM1
SCHEMBL7070471 0.71 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402639-B2 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators CIBA SPECIALTY CHEMICALS CORP. (US) 2008-07-22 US disclosed
US-6927295-B2 A polymerization catalyst for free radical polymerization of ethylenically unsaturated monomers CIBA SPECIALTY CHEMICALS CORP. (US) 2005-08-09 US disclosed
US-20050131177-A1 1-Alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (SE) 2005-06-16 US disclosed
US-6683142-B2 PROVIDE POLYMERIC RESIN PRODUCTS HAVING LOW POLYDISPERSITY. CIBA SPECIALTY CHEMICALS CORPORATION 2004-01-27 US disclosed
US-20030220423-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (CH) 2003-11-27 US disclosed
US-20020107397-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (CH) 2002-08-08 US disclosed
US-6353107-B1 FREE RADICAL CATALYSTS FOR ADDITION POLYMERIZATION; NARROW MOLECULAR WEIGHT DISTRIBUTION; HIGH PURITY AND COLORLESS CIBA SPECIALTY CHEMICALS CORPORATION 2002-03-05 US 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 (3 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-20050131177-A1 1-Alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators PYM1, PTGER1, CBR1 ALDH1A1 638/4885MAPT 4633/4885DHFR 3068/4885
US-20020107397-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators CBR1, PYM1, ELOC ALDH1A1 508/4885MAPT 4391/4885DHFR 2683/4885
US-20030220423-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators PYM1, ELOC, CBR1 ALDH1A1 666/4885MAPT 4497/4885DHFR 2589/4885

“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.