SCHEMBL4755987

SCHEMBL4755987

COC(=O)C(C)(C)Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.72
PPARG P37231 3/20 0.72
FABP2 P12104 2/20 0.72
SLC22A12 Q96S37 1/20 0.72
CYP1A2 P05177 4/20 0.72
CYP3A4 P08684 4/20 0.72
CYP2C19 P33261 3/20 0.72
MAPT P10636 3/20 0.72
SMN1; SMN2 Q16637 3/20 0.72
HPGD P15428 2/20 0.72
ABCB11 O95342 2/20 0.72
TSHR P16473 2/20 0.72
HTR2A P28223 2/20 0.72
PMP22 Q01453 2/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
CYP2C9 P11712 2/20 0.72
USP2 O75604 2/20 0.72
LMNA P02545 1/20 0.72
ADORA3 P0DMS8 1/20 0.72

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
SCHEMBL31084129 0.94 PPARA (0.69) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL2121452 0.92 PPARA (0.68) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL21991231 0.87 PPARA (0.62) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL11684008 0.87 PPARA (0.62) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL823203 0.86 PPARA (0.70) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL4755982 0.86 PPARA (0.70) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL11441181 0.86 ELANE (0.66) PPARAPPARGFABP2SLC22A12CYP1A2
Fenofibric Acid SCHEMBL30777817 0.84 PPARA (0.72) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL13984052 0.84 PPARA (0.77) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL822492 0.84 PPARA (0.77) PPARAPPARGFABP2SLC22A12CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1019016-A None JP disclosed
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-10940132-B2 CCL5 inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20200138766-A1 CCL5 INHIBITORS LAPKO INC. DBA AFECTA PHARMACEUTICALS 2020-05-07 US disclosed
US-20110136767-A1 PROCESSES FOR PREPARING PIPERAZINIUM SALTS OF KMUP AND USE THEREOF KAOHSIUNG MEDICAL UNIVERSITY (TW) 2011-06-09 US disclosed
WO-2010086700-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF CHOLINE SALT OF FENOFIBRIC ACID AND ITS NOVEL POLYMORPH ALEMBIC LIMITED (IN) 2010-08-05 WO disclosed
WO-2008157537-A2 COMPOSITIONS AND METHODS OF USE FOR TREATING OR PREVENTING LIPID RELATED DISORDERS IRONWOOD PHARMACEUTICALS, INC (US) 2008-12-24 WO disclosed
JP-S6419016-A LIPID CONTROL COMPOSITION WARNER LAMBERT CO 1989-01-23 JP disclosed
JP-S06419016-A 0001-01-01 JP 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 (7 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-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885
US-20110136767-A1 PROCESSES FOR PREPARING PIPERAZINIUM SALTS OF KMUP AND USE THEREOF U2SURP, RRP15, KYNU PPARA 2092/4885PPARG 1727/4885FABP2 4781/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PPARA 806/4885PPARG 1583/4885FABP2 586/4885

“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.