SCHEMBL6468289

SCHEMBL6468289

CCc1ccn2nccc2n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.44
MET P08581 1/20 0.40
SCN5A Q14524 1/20 0.39
TGFBR1 P36897 4/20 0.38
PRKAB2 O43741 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAG3 Q9UGI9 1/20 0.36
PRKAG2 Q9UGJ0 1/20 0.36
PRKAB1 Q9Y478 1/20 0.36
PCSK9 Q8NBP7 1/20 0.36
PIK3CD O00329 1/20 0.33
IRAK4 Q9NWZ3 3/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
NAMPT P43490 1/20 0.31
CBLB Q13191 1/20 0.30

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
SCHEMBL16848813 0.85 DYRK1A (0.41) DYRK1AMETSCN5ATGFBR1PRKAB2
SCHEMBL5872614 0.81 KCNH2 (0.51) DYRK1AMETSCN5ATGFBR1
SCHEMBL2177217 0.81 DYRK1A (0.47) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL23529908 0.81 DYRK1A (0.44) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL3347070 0.81 DYRK1A (0.44) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL21167757 0.80 DYRK1A (0.41) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL7481486 0.80 DYRK1A (0.41) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL3347107 0.77 DYRK1A (0.41) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL23869389 0.75 DYRK1A (0.43) DYRK1AMETSCN5ATGFBR1PCSK9
SCHEMBL3346732 0.74 DYRK1A (0.36) DYRK1AMETSCN5ATGFBR1PCSK9

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030878-B2 Substituted indole ether compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-09 US disclosed
US-20230353959-A1 PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-11-02 US disclosed
US-20230312565-A1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-10-05 US disclosed
WO-2023081759-A1 BIFUNCTIONAL PI3K-ALPHA INHIBITORS AND USES THEREOF RELAY THERAPEUTICS, INC. (US) 2023-05-11 WO disclosed
US-20210070751-A1 SUBSTITUTED INDOLE ETHER COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-03-11 US disclosed
US-10781215-B2 Heterobicyclic compounds useful as modulators of IL-12, IL-23 and/or IFNα responses BRISTOL-MYERS SQUIBB COMPANY (US) 2020-09-22 US disclosed
US-20200102311-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 US disclosed
US-20190322672-A1 HETEROBICYCLIC COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2019-10-24 US disclosed
WO-2019148005-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF NURIX THERAPEUTICS, INC. (US) 2019-08-01 WO disclosed
WO-2016133838-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-08-25 WO disclosed
US-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2012-05-03 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 (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-10781215-B2 Heterobicyclic compounds useful as modulators of IL-12, IL-23 and/or IFNα responses TYK2, IL2, IL23R DYRK1A 61/4885MET 2654/4885SCN5A 4355/4885
US-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS PTAFR, PAFAH1B2, PAFAH1B3 DYRK1A 3380/4885MET 2809/4885SCN5A 3241/4885
US-20190322672-A1 HETEROBICYCLIC COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES TYK2, IL2, IFNG DYRK1A 69/4885MET 2869/4885SCN5A 3964/4885
US-20200102311-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP DYRK1A 3616/4885MET 4165/4885SCN5A 1822/4885
US-20230312565-A1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 DYRK1A 3491/4885MET 313/4885SCN5A 3871/4885
US-20210070751-A1 SUBSTITUTED INDOLE ETHER COMPOUNDS TLR7, TLR8, TLR1 DYRK1A 2190/4885MET 3112/4885SCN5A 2211/4885
US-12030878-B2 Substituted indole ether compounds TLR7, TLR8, TLR1 DYRK1A 2190/4885MET 3112/4885SCN5A 2211/4885

“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.