SCHEMBL6174558

SCHEMBL6174558

CC1(C)CC(C(=O)O)CC(C)(C)N1OC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.42
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 2/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
EPHX1 P07099 1/20 0.31
S1PR5 Q9H228 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
SCHEMBL9273053 0.81 TSHR (0.31) TSHRKMT2A
SCHEMBL10067197 0.80 TSHR (0.38) CYP2C19ALDH1A1CYP1A2ALOX15TSHR
SCHEMBL9334229 0.80 TSHR (0.33) TSHRKMT2A
SCHEMBL13474861 0.80 TSHR (0.35) CYP2C19ALDH1A1TSHRKMT2APOLB
Acetic Acid SCHEMBL4438748 0.80 TSHR (0.33) ALDH1A1TSHRKMT2A
SCHEMBL646221 0.79
SCHEMBL4807341 0.79
SCHEMBL8462829 0.79 TSHR (0.49) CYP2C19ALDH1A1TSHRKMT2AGAA
SCHEMBL9350975 0.78 TSHR (0.33) TSHR
SCHEMBL16501810 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379587-B1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH CIBA SC HOLDING AG (CH) 2005-02-02 EP claimed
US-20040138452-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2004-07-15 US claimed
EP-1379587-A1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH Ciba SC Holding AG (CH) 2004-01-14 EP claimed
US-20030125555-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2003-07-03 US claimed
US-20030109704-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2003-06-12 US claimed
WO-2002083781-A1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH CIBA SPECIALTY CHEMICALS HOLDING INC. (US) 2002-10-24 WO claimed
US-6875870-B2 Long chain hindered amines and compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-04-05 US disclosed
EP-1379587-B1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH CIBA SC HOLDING AG (CH) 2005-02-02 EP disclosed
US-20040138452-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2004-07-15 US disclosed
US-6755875-B2 PIPERIDINE-N-OXY GROUP CONTAINING COMPOUNDS STABILIZES WHITE, DYED, DIPPED, UNSCENTED OR SCENTED CANDLE WAX AGAINST DISCOLRATION AND FADING CIBA SPECIALTY CHEMICALS CORPORATION 2004-06-29 US disclosed
US-6699298-B2 DISCOLORATION INHIBITION CANDLE WAX CIBA SPECIALTY CHEMICALS CORPORATION 2004-03-02 US disclosed
EP-1379587-A1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH Ciba SC Holding AG (CH) 2004-01-14 EP disclosed
US-20030125555-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2003-07-03 US disclosed
US-20030109704-A1 Long chain hindered amines and compositions stabilized therewith WOOD MERVIN G (US) 2003-06-12 US disclosed
WO-2002083781-A1 LONG CHAIN HINDERED AMINES AND COMPOSITIONS STABILIZED THEREWITH CIBA SPECIALTY CHEMICALS HOLDING INC. (US) 2002-10-24 WO disclosed
US-6465645-B1 CONTAINING TRIAZINE GROUPS AND N-ALKYLOXYPIPERIDINE GROUPS; CANDLE WAX WHICH IS EFFECTIVELY STABILIZED AGAINST DISCOLORATION AND FADING CIBA SPECIALTY CHEMICALS CORPORATION 2002-10-15 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-20030109704-A1 Long chain hindered amines and compositions stabilized therewith TYR, DDC, AOC2 APLNR 3327/4885CYP2C19 1021/4885KDM4E 2699/4885
US-20030125555-A1 Long chain hindered amines and compositions stabilized therewith TYR, DDC, AOC2 APLNR 3327/4885CYP2C19 1021/4885KDM4E 2699/4885
US-20040138452-A1 Long chain hindered amines and compositions stabilized therewith TYR, DDC, AOC2 APLNR 3327/4885CYP2C19 1021/4885KDM4E 2699/4885

“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.