SCHEMBL17868442

SCHEMBL17868442

NCC1(O)CCN(C(=O)c2ccc(F)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
HSD11B1 P28845 2/20 0.50
POLB P06746 1/20 0.50
GPR183 P32249 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
USP7 Q93009 1/20 0.47
HSP90AA1 P07900 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL3911482 0.85 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL11889045 0.78 HSD11B1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL17868397 0.78 HSD11B1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL22305103 0.78 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL6985975 0.78 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL11888888 0.77 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL3755574 0.76 POLB (0.66) CA12CA1CA2CA7CA9
SCHEMBL8160260 0.76 SLC6A7 (0.57) CA12CA1CA2CA7CA9
SCHEMBL21976432 0.75 PARP14 (0.57) CA12CA1CA2CA7CA9
SCHEMBL21166248 0.75 SLC6A7 (0.57) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-10-24 US disclosed
US-11739071-B2 Quinazolinones and azaquinazolinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-08-29 US disclosed
US-11739071-B2 Quinazolinones and azaquinazolinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-08-29 US disclosed
US-11739071-B2 Quinazolinones and azaquinazolinones as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2023-08-29 US disclosed
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2022-02-03 US disclosed
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2022-02-03 US disclosed
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-21 US disclosed
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-21 US disclosed
WO-2016126935-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2016-08-11 WO disclosed
WO-2016126935-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2016-08-11 WO disclosed
US-20160229833-A1 QUINAZOLINONES AND AZAQUINAZOLINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-08-11 US disclosed
US-20160229833-A1 QUINAZOLINONES AND AZAQUINAZOLINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-08-11 US disclosed
WO-2016126926-A1 QUINAZOLINONES AND AZAQUINAZOLINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2016-08-11 WO disclosed
WO-2016109480-A1 PYRROLOTRIAZINONE AND IMIDAZOTRIAZINONE DERIVATIVES AS UBIQUITIN-SPECIFIC PROTEASE 7 (USP7) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS, INC. (US) 2016-07-07 WO disclosed
WO-2016109480-A1 PYRROLOTRIAZINONE AND IMIDAZOTRIAZINONE DERIVATIVES AS UBIQUITIN-SPECIFIC PROTEASE 7 (USP7) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS, INC. (US) 2016-07-07 WO disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 US disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 US disclosed
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS Valo Health, LLC 2016-06-30 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 (6 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-11739071-B2 Quinazolinones and azaquinazolinones as ubiquitin-specific protease 7 inhibitors USP7, UBQLN1, UBA7 CA12 4631/4885CA1 3491/4885CA2 4508/4885
US-20160185786-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 CA12 4786/4885CA1 3274/4885CA2 3885/4885
US-20160229833-A1 QUINAZOLINONES AND AZAQUINAZOLINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBQLN1, UBA7 CA12 4631/4885CA1 3491/4885CA2 4508/4885
US-20220033403-A1 PYRROLOTRIAZINONES AND IMIDAZOTRIAZINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, PSMB7 CA12 4786/4885CA1 3274/4885CA2 3885/4885
US-11795171-B2 Pyrrolotriazinones and imidazotriazinones as ubiquitin-specific protease 7 inhibitors USP7, UBA7, PSMB7 CA12 4786/4885CA1 3274/4885CA2 3885/4885
US-20210323978-A1 ISOTHIAZOLOPYRIMIDINONES, PYRAZOLOPYRIMIDINONES, AND PYRROLOPYRIMIDINONES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, USP3, SENP7 CA12 4760/4885CA1 3469/4885CA2 4311/4885

“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.