SCHEMBL78402

SCHEMBL78402

COC(=O)c1cc(C)[nH]c1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 4/20 0.46
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 4/20 0.43
GLA P06280 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41

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
SCHEMBL10717450 0.81 MAPT (0.49) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL15568713 0.80 MAPT (0.51) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL10747580 0.80 ALDH1A1 (0.69) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL31134834 0.80 MAPT (0.51) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL14269811 0.80 MAPT (0.47) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL5357593 0.79 MAPT (0.41) MAPTKDM4EALDH1A1L3MBTL1LMNA
SCHEMBL25296768 0.77 MAPT (0.49) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL31304872 0.77 MAPT (0.45) MAPTKDM4EALDH1A1L3MBTL1GAA
SCHEMBL10717495 0.77 MAPT (0.49) MAPTKDM4EALDH1A1PDE3BPDE3A
SCHEMBL7298645 0.77 MAPT (0.49) MAPTKDM4EALDH1A1PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104638808-A Self-centering heat-proof thrust bearing housing structure for submersible motor and manufacturing method JINZHOU WATER PUMP FACTORY 2015-05-20 CN claimed
US-20240336604-A1 D3 DOPAMINE RECEPTOR-SELECTIVE NEGATIVE ALLOSTERIC MODULATORS US HEALTH (US) 2024-10-10 US disclosed
EP-4380921-A1 D3 DOPAMINE RECEPTOR-SELECTIVE NEGATIVE ALLOSTERIC MODULATORS The United States of America, as represented by The Secretary, Department of Health and Human Services (US) 2024-06-12 EP disclosed
CN-117209469-A Compounds as CLK inhibitors and uses thereof 南京圣和药物研发有限公司 2023-12-12 CN disclosed
CN-112679489-B N-sulfonyl heterocyclic derivative and pharmaceutical use thereof 重庆医科大学 2023-07-25 CN disclosed
WO-2023014768-A1 D3 DOPAMINE RECEPTOR-SELECTIVE NEGATIVE ALLOSTERIC MODULATORS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-02-09 WO disclosed
WO-2023014768-A1 D3 DOPAMINE RECEPTOR-SELECTIVE NEGATIVE ALLOSTERIC MODULATORS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-02-09 WO disclosed
US-20220144809-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2022-05-12 US disclosed
WO-2022098544-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-05-12 WO disclosed
EP-3305778-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-19 EP disclosed
US-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents ASTRAZENECA AB, A SWEDEN CORPORATION 2008-06-26 US disclosed
US-7361660-B2 Chemical compounds ASTRAZENECA AB (SE) 2008-04-22 US disclosed
EP-1412362-B1 THIENO¬2,3-d|PYRIMIDINEDIONES AS INHIBITORS OF T-CELLS PROLIFERATION ASTRAZENECA AB (SE) 2006-08-02 EP disclosed
US-20050101657-A1 Pyrrole derivatives for preventing or treating cancer sensitive to hormones; administered with luteininzing hormone releasing hormone derivative TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2005-05-12 US disclosed
EP-1466902-A1 ANDROGEN RECEPTOR ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2004-10-13 EP disclosed
US-20040171623-A1 Chemical compounds ASTRAZENECA AB (SE) 2004-09-02 US disclosed
EP-1412362-A1 CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2004-04-28 EP disclosed
WO-2003008422-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2003-01-30 WO disclosed
EP-0300688-A1 Pyrrole derivatives, process for their preparation and pharmaceutical compositions containing them FISONS plc (GB) 1989-01-25 EP disclosed
EP-0230110-A1 Pharmacologically active pyrrole and pyrazole derivatives FISONS plc (GB) 1987-07-29 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 (5 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-20220144809-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AND ASSOCIATED METHODS OF USE AR, ADRM1, CRBN MAPT 2733/4885KDM4E 1631/4885ALDH1A1 1867/4885
US-20050101657-A1 Pyrrole derivatives for preventing or treating cancer sensitive to hormones; administered with luteininzing hormone releasing hormone derivative SHBG, PRLHR, FSHR MAPT 4864/4885KDM4E 1858/4885ALDH1A1 2144/4885
US-20240336604-A1 D3 DOPAMINE RECEPTOR-SELECTIVE NEGATIVE ALLOSTERIC MODULATORS OPRD1, DRD3, OPRK1 MAPT 2099/4885KDM4E 2391/4885ALDH1A1 2136/4885
US-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents HRH4, HRH2, HRH3 MAPT 4772/4885KDM4E 2323/4885ALDH1A1 463/4885
US-20040171623-A1 Chemical compounds CBR1, SETDB1, CBR3 MAPT 4392/4885KDM4E 181/4885ALDH1A1 401/4885

“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.