SCHEMBL3307629

SCHEMBL3307629

C#CCOc1ccccc1C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.53
SLC6A3 Q01959 2/20 0.51
HSP90AA1 P07900 2/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 4/20 0.49
TSHR P16473 2/20 0.49
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLC6A4 P31645 1/20 0.46
MAOA P21397 1/20 0.46

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
Methyl Salicylate SCHEMBL29784435 0.93 TSHR (0.61) NPC1SLC6A3HSP90AA1MAPTHTT
SCHEMBL8727421 0.85 SLC6A3 (0.53) SLC6A3HSP90AA1MAPTHTTNPSR1
SCHEMBL21434742 0.85 NPC1 (0.44) NPC1SLC6A3MAPTHTTALDH1A1
SCHEMBL6948700 0.84 ALDH1A1 (0.52) SLC6A3HSP90AA1MAPTHTTNPSR1
SCHEMBL11637190 0.83 LMNA (0.60) NPC1MAPTHTTALDH1A1L3MBTL1
SCHEMBL18026668 0.83 HCRTR1 (0.49) NPC1MAPTMEN1GAAKMT2A
SCHEMBL7349998 0.82 MAOB (0.57) NPC1SLC6A3HTTNPSR1ALDH1A1
SCHEMBL5763096 0.82 FFAR4 (0.55) NPC1SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL15273702 0.82 MAOA (0.45) NPC1SLC6A3HSP90AA1MAPTHTT
SCHEMBL26040512 0.82 PLK1 (0.46) NPC1ALDH1A1LMNACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216378-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2024-07-04 US disclosed
US-20240216378-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2024-07-04 US disclosed
US-20240216378-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2024-07-04 US disclosed
US-20240109899-A1 BENZOFURAN COMPOUNDS AS STING AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-04 US disclosed
US-11931363-B2 Triazolopyrimidine compounds and uses thereof NOVARTIS AG (CH) 2024-03-19 US disclosed
US-20230033320-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH (CN) 2023-02-02 US disclosed
US-20230033320-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH (CN) 2023-02-02 US disclosed
WO-2022169921-A1 BENZOFURAN COMPOUNDS AS STING AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2022-08-11 WO disclosed
US-11207325-B2 Triazolopyrimidine compounds and uses thereof NOVARTIS AG (CH) 2021-12-28 US disclosed
US-11207325-B2 Triazolopyrimidine compounds and uses thereof NOVARTIS AG (CH) 2021-12-28 US disclosed
WO-2016103155-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2016-06-30 WO disclosed
US-20160176882-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2016-06-23 US disclosed
US-20160176882-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2016-06-23 US disclosed
US-20160176882-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2016-06-23 US disclosed
US-20100113747-A1 Coupling of Antibody Polypeptides at the C-Terminus NOVO NORDISK A/S (DK) 2010-05-06 US disclosed
US-20100113747-A1 Coupling of Antibody Polypeptides at the C-Terminus NOVO NORDISK A/S (DK) 2010-05-06 US disclosed
US-20100113747-A1 Coupling of Antibody Polypeptides at the C-Terminus NOVO NORDISK A/S (DK) 2010-05-06 US disclosed
EP-2115001-A1 COUPLING OF ANTIBODY POLYPEPTIDES AT THE C-TERMINUS Novo Nordisk A/S (DK) 2009-11-11 EP disclosed
WO-2008107260-A1 COUPLING OF ANTIBODY POLYPEPTIDES AT THE C-TERMINUS NOVO NORDISK A/S (DK) 2008-09-12 WO disclosed
WO-2008107260-A1 COUPLING OF ANTIBODY POLYPEPTIDES AT THE C-TERMINUS NOVO NORDISK A/S (DK) 2008-09-12 WO 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-11931363-B2 Triazolopyrimidine compounds and uses thereof EZH2, DOT1L, EED NPC1 2908/4885SLC6A3 3401/4885HSP90AA1 3660/4885
US-11207325-B2 Triazolopyrimidine compounds and uses thereof EZH2, DOT1L, EED NPC1 2908/4885SLC6A3 3401/4885HSP90AA1 3660/4885
US-20100113747-A1 Coupling of Antibody Polypeptides at the C-Terminus FCGRT, FCGR3B, FCGR2A NPC1 4413/4885SLC6A3 4719/4885HSP90AA1 3047/4885
US-20240109899-A1 BENZOFURAN COMPOUNDS AS STING AGONISTS STING1, MAVS, IRF3 NPC1 692/4885SLC6A3 4629/4885HSP90AA1 1115/4885
US-20240216378-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF EZH2, DOT1L, EED NPC1 2908/4885SLC6A3 3401/4885HSP90AA1 3660/4885
US-20160176882-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF EZH2, DOT1L, EED NPC1 2908/4885SLC6A3 3401/4885HSP90AA1 3660/4885
US-20230033320-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF EZH2, DOT1L, EED NPC1 2908/4885SLC6A3 3401/4885HSP90AA1 3660/4885

“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.