SCHEMBL20122885

SCHEMBL20122885

Clc1ccc(-c2cc(Cl)cc3c4ccncc4n(CC4CC4)c23)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.49
DYRK1A Q13627 3/20 0.49
NFATC1 O95644 1/20 0.42
GSK3B P49841 1/20 0.42
ROCK2 O75116 1/20 0.42
PTGER4 P35408 2/20 0.40
METAP2 P50579 1/20 0.39
KDM4C Q9H3R0 1/20 0.38
CRHR1 P34998 1/20 0.35
MAT2A P31153 1/20 0.35
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
GRM2 Q14416 1/20 0.34
NLRP3 Q96P20 1/20 0.33
IDO1 P14902 1/20 0.33
SLC34A1 Q06495 2/20 0.33
TACR1 P25103 1/20 0.33

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
SCHEMBL30664200 1.00 KCNH2 (0.49) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL20122886 0.92 DYRK1A (0.46) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL20122876 0.89 ROCK2 (0.45) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL30664155 0.89 ROCK2 (0.45) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL30664172 0.86 DYRK1A (0.45) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL20123075 0.86 DYRK1A (0.45) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL30664277 0.85 KCNH2 (0.39) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL20123069 0.85 KCNH2 (0.39) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL20123010 0.83 ROCK2 (0.40) KCNH2DYRK1ANFATC1GSK3BROCK2
SCHEMBL30664221 0.83 ROCK2 (0.40) KCNH2DYRK1ANFATC1GSK3BROCK2

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 5 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-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 KCNH2 3028/4885DYRK1A 493/4885NFATC1 1647/4885
US-11130755-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders COL2A1, IDO1, COL1A1 KCNH2 3028/4885DYRK1A 493/4885NFATC1 1647/4885

“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.