SCHEMBL20985694

SCHEMBL20985694

COc1ncccc1-c1cc(C(F)(F)F)nc(SC)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 6/20 0.42
GAA P10253 1/20 0.41
HPGD P15428 5/20 0.41
KDM4E B2RXH2 4/20 0.41
LMNA P02545 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MITF O75030 1/20 0.41
STAT3 P40763 1/20 0.41
HTT P42858 1/20 0.41
CHRNA7 P36544 2/20 0.41
HRH4 Q9H3N8 1/20 0.41
ALDH1A1 P00352 5/20 0.40
MAPT P10636 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
HSD17B10 Q99714 3/20 0.39
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL29975933 1.00 GPBAR1 (0.42) GPBAR1GAAHPGDKDM4ELMNA
SCHEMBL19805650 0.78 GAA (0.43) GPBAR1GAAHPGDKDM4ELMNA
SCHEMBL29975711 0.78 GAA (0.43) GPBAR1GAAHPGDKDM4ELMNA
SCHEMBL19805613 0.78 NPSR1 (0.69) GPBAR1HPGDKDM4ELMNANPSR1
SCHEMBL76562 0.76 GAA (0.50) GAAKDM4ELMNANPSR1ALDH1A1
SCHEMBL29977085 0.76 MEN1 (0.44) HPGDKDM4ELMNANPSR1MITF
SCHEMBL19806062 0.76 SDHB (0.59) GPBAR1HPGDKDM4ELMNANPSR1
SCHEMBL19805929 0.76 MEN1 (0.44) HPGDKDM4ELMNANPSR1MITF
SCHEMBL29976648 0.75 LMNA (0.63) HPGDKDM4ELMNANPSR1MITF
SCHEMBL19805783 0.74 MEN1 (0.42) HPGDKDM4ELMNANPSR1MITF

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
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 US disclosed
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 US disclosed
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 US disclosed
CN-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 CN disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 US disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 US disclosed
US-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 US disclosed
US-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 US disclosed
EP-3484854-B1 APOPTOSIS INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-01-20 EP disclosed
EP-3484854-B1 APOPTOSIS INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-01-20 EP disclosed
US-20190152960-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-05-23 US disclosed
US-20190152960-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-05-23 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 (4 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-20190152960-A1 Apoptosis Inhibitors BAX, SDHA, SDHB GPBAR1 2109/4885GAA 910/4885HPGD 208/4885
US-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB GPBAR1 2109/4885GAA 910/4885HPGD 208/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB GPBAR1 2109/4885GAA 910/4885HPGD 208/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB GPBAR1 2109/4885GAA 910/4885HPGD 208/4885

“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.