SCHEMBL1913003

SCHEMBL1913003

COC(=O)[C@H]1CC[C@H](COCc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
ACHE P22303 2/20 0.44
GAA P10253 1/20 0.44
CPB1 P15086 1/20 0.43

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
SCHEMBL757461 1.00 ALDH1A1 (0.50) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL2374934 0.86 PKM (0.52) ALDH1A1MAPTNPSR1
SCHEMBL2374933 0.86 PKM (0.52) ALDH1A1MAPTNPSR1
SCHEMBL25877951 0.85 ALDH1A1 (0.45) ALDH1A1CTSLCTSBCTSKGAA
SCHEMBL22849511 0.85 ALDH1A1 (0.55) ALDH1A1CTSLCTSBCTSKGAA
SCHEMBL3398972 0.85 ALDH1A1 (0.55) ALDH1A1CTSLCTSBCTSKGAA
SCHEMBL24373187 0.84 AGTR2 (0.41) ALDH1A1GAA
SCHEMBL28840618 0.84 ALDH1A1 (0.43) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL15012790 0.83 ALDH1A1 (0.45) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL15012791 0.83 ALDH1A1 (0.45) ALDH1A1MAPTHPGDNPSR1HSD17B10

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11857535-B2 Methods of treating mutant lymphomas KYMERA THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-11857535-B2 Methods of treating mutant lymphomas KYMERA THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-11779578-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-11707457-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-07-25 US disclosed
US-20230144292-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-11 US disclosed
US-20230122219-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-20 US disclosed
WO-2023283610-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
WO-2023283372-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
WO-2022147465-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-07-07 WO disclosed
US-20120208816-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-08-16 US disclosed
US-8193349-B2 4-benzylamino-1-carboxylacyl-piperidine derivatives as CETP inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
US-8193349-B2 4-benzylamino-1-carboxylacyl-piperidine derivatives as CETP inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
EP-2404901-A1 1,2-Disubstituted 4-benzylamino-pyrrolidine derivatives as CETP inhibitors useful for the treatment of diseases such as hyperlipidemia or arteriosclerosis Novartis AG (CH) 2012-01-11 EP disclosed
EP-2229356-B1 1,2-DISUBSTITUTED-4-BENZYLAMINO-PYRROLIDINE DERIVATIVES AS CETP INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES SUCH AS HYPERLI PIDEMIA OR ARTERIOSCLEROSIS NOVARTIS AG (CH) 2011-10-12 EP disclosed
US-20100311750-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-12-09 US disclosed
US-20100311750-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-12-09 US disclosed
WO-2009059943-A1 4-BENZYLAMINO-1-CARBOXYACYL-PIPERIDINE DERIVATIVES AS CETP INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES SUCH AS HYPERLIPIDEMIA OR ARTERIOSCLEROSIS NOVARTIS AG (CH) 2009-05-14 WO disclosed
US-20090118287-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-05-07 US disclosed
US-20090118287-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-05-07 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 (9 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-11857535-B2 Methods of treating mutant lymphomas IRAK4, IRAK2, IRAK3 ALDH1A1 2878/4885MAPT 3618/4885HPGD 4596/4885
US-20090118287-A1 ORGANIC COMPOUNDS CETP, NPC1, CES1 ALDH1A1 1701/4885MAPT 1522/4885HPGD 3425/4885
US-20230122219-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPT 2459/4885HPGD 3843/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPT 2459/4885HPGD 3843/4885
US-11779578-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPT 2459/4885HPGD 3843/4885
US-20120208816-A1 ORGANIC COMPOUNDS CETP, NPC1, CES1 ALDH1A1 1701/4885MAPT 1522/4885HPGD 3425/4885
US-20100311750-A1 ORGANIC COMPOUNDS CETP, NPC1, CES1 ALDH1A1 1789/4885MAPT 1488/4885HPGD 3694/4885
US-11707457-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPT 2459/4885HPGD 3843/4885
US-20230144292-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPT 2459/4885HPGD 3843/4885

“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.