SCHEMBL20123049

SCHEMBL20123049

CCc1cc2c3cc(Br)cc(-c4cnn(C)c4)c3n(CC)c2c(C)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.36
AXL P30530 2/20 0.35
PIK3CA P42336 5/20 0.33
CHEK1 O14757 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CCNA1 P78396 1/20 0.32
GRM2 Q14416 4/20 0.32
HSP90AA1 P07900 1/20 0.31
AKT1 P31749 1/20 0.31
MTOR P42345 1/20 0.31
LRRK2 Q5S007 1/20 0.31
BRD4 O60885 1/20 0.30
MAPT P10636 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
SCHEMBL30664145 1.00 PDPK1 (0.36) PDPK1AXLPIK3CACHEK1CCNA2
SCHEMBL20122815 0.89 GRM2 (0.36) AXLPIK3CACHEK1CCNA2CDK2
SCHEMBL29756295 0.89 GRM2 (0.36) AXLPIK3CACHEK1CCNA2CDK2
SCHEMBL30664160 0.83 GRM2 (0.36) PDPK1AXLPIK3CACHEK1CCNA2
SCHEMBL20122982 0.83 GRM2 (0.36) PDPK1AXLPIK3CACHEK1CCNA2
SCHEMBL29756325 0.83 DYRK1A (0.41) AXLMTORLRRK2
SCHEMBL20123032 0.83 DYRK1A (0.41) AXLMTORLRRK2
SCHEMBL20123046 0.73 PDPK1 (0.31) PDPK1
SCHEMBL20122904 0.71 DYRK1A (0.42) MTORLRRK2
SCHEMBL20122935 0.70 DYRK1A (0.41) GRM2MTORLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827633-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders SANOFI (FR) 2023-11-28 US disclosed
US-11827633-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders SANOFI (FR) 2023-11-28 US disclosed
US-11130755-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders SANOFI (FR) 2021-09-28 US disclosed
EP-3792262-A1 SUBSTITUTED PYRIDO[3,4-B]INDOLES FOR THE TREATMENT OF CARTILAGE DISORDERS SANOFI (FR) 2021-03-17 EP disclosed
EP-3535263-B1 SUBSTITUTED PYRIDO[3,4-B]INDOLES FOR THE TREATMENT OF CARTILAGE DISORDERS SANOFI SA (FR) 2020-09-30 EP disclosed
EP-3318563-A1 SUBSTITUTED PYRIDO[3,4-B]INDOLES FOR THE TREATMENT OF CARTILAGE DISORDERS SANOFI (FR) 2018-05-09 EP 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 (2 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-11827633-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders COL2A1, IDO1, COL1A1 PDPK1 1669/4885AXL 3728/4885PIK3CA 1083/4885
US-11130755-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders COL2A1, IDO1, COL1A1 PDPK1 1669/4885AXL 3728/4885PIK3CA 1083/4885

“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.