SCHEMBL2953175

SCHEMBL2953175

Cc1n[nH]c2ncc(B3OC(C)(C)C(C)(C)O3)cc12

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48
PDGFRB P09619 2/20 0.35
KDR P35968 2/20 0.35
PRMT5 O14744 2/20 0.34
WDR77 Q9BQA1 2/20 0.34
DGAT1 O75907 2/20 0.33
EGFR P00533 2/20 0.33
AAK1 Q2M2I8 1/20 0.33
ALPL P05186 1/20 0.32
LPL P06858 5/20 0.32
LIPG Q9Y5X9 5/20 0.32
FFAR1 O14842 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL29382931 1.00 GSK3A (0.48) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL18050740 0.82 GSK3A (0.51) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL9904691 0.81 GSK3A (0.45) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL29382832 0.77 GSK3A (0.57) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL2959525 0.77 GSK3A (0.43) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL2966812 0.77 GSK3A (0.43) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL29380963 0.77 GSK3A (0.43) GSK3AGSK3BPDGFRBKDRPRMT5
SCHEMBL30379604 0.75 PRMT5 (0.42) GSK3AGSK3BPRMT5WDR77EGFR
SCHEMBL1519972 0.75 PRMT5 (0.42) GSK3AGSK3BPRMT5WDR77EGFR
SCHEMBL1585585 0.74 GSK3A (0.45) GSK3AGSK3BPDGFRBKDRDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3268373-B1 TRICYCLIC DLK INHIBITORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2022-04-27 EP disclosed
EP-3268373-B1 TRICYCLIC DLK INHIBITORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2022-04-27 EP disclosed
WO-2021249913-A1 2'-(QUINOLIN-3-YL)-5',6'-DIHYDROSPIRO[AZETIDINE-3,4'-PYRROLO[1,2-B]PYRAZOLE]-1-CARBOXYLATE DERIVATIVES AND RELATED COMPOUNDS AS MAP4K1 (HPK1) INHIBITORS FOR THE TREATMENT OF CANCER BAYER AKTIENGESELLSCHAFT (DE) 2021-12-16 WO disclosed
CN-107406462-B Tricyclic DLK inhibitors and uses thereof 豪夫迈·罗氏有限公司 2020-11-10 CN disclosed
US-20190071416-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-07 US disclosed
US-10131675-B2 Tricyclic DLK inhibitors and uses thereof GENENTECH, INC. (US) 2018-11-20 US disclosed
US-9962382-B2 Substituted 5-(pyrazin-2-yl)-1H-pyrazolo [3, 4-b] pyridine and pyrazolo [3, 4-b] pyridine derivatives as protein kinase inhibitors ARRIEN PHARMACEUTICALS LLC (US) 2018-05-08 US disclosed
EP-3268373-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2018-01-17 EP disclosed
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2017-12-28 US disclosed
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2017-12-28 US disclosed
WO-2016142310-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2016-09-15 WO disclosed
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
EP-2183243-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS Pfizer Inc. (US) 2010-05-12 EP disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
WO-2009016460-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS PFIZER INC. (US) 2009-02-05 WO disclosed
WO-2009016460-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS PFIZER INC. (US) 2009-02-05 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 (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-20190071416-A1 COMPOUNDS FOR TREATMENT OF CANCER AND EPIGENETICS SMYD3, SMYD2, EHMT1 GSK3A 1761/4885GSK3B 1645/4885PDGFRB 4316/4885
US-10131675-B2 Tricyclic DLK inhibitors and uses thereof NLK, DCLK2, DLK1 GSK3A 468/4885GSK3B 445/4885PDGFRB 3189/4885
US-20090221608-A1 PYRAZOLE COMPOUNDS BRAF, RAF1, NRAS GSK3A 298/4885GSK3B 168/4885PDGFRB 1145/4885
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF NLK, DCLK2, DLK1 GSK3A 468/4885GSK3B 445/4885PDGFRB 3189/4885

“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.