SCHEMBL20122858

SCHEMBL20122858

Fc1cncc(-c2cc(Cl)cc3c4ccncc4n(CC(F)(F)F)c23)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 3/20 0.39
CYP11B2 P19099 3/20 0.38
METAP2 P50579 12/20 0.38
NFATC1 O95644 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
CYP17A1 P05093 2/20 0.35
CYP11B1 P15538 2/20 0.35
CYP3A4 P08684 1/20 0.35
KDM4C Q9H3R0 1/20 0.34

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
SCHEMBL30664341 1.00 ROCK2 (0.39) ROCK2CYP11B2METAP2NFATC1GSK3B
SCHEMBL30664250 0.89 ROCK2 (0.41) ROCK2CYP11B2METAP2
SCHEMBL20122999 0.89 ROCK2 (0.41) ROCK2CYP11B2METAP2
SCHEMBL30664346 0.89 METAP2 (0.47) ROCK2METAP2NFATC1GSK3BDYRK1A
SCHEMBL20122790 0.89 METAP2 (0.47) ROCK2METAP2NFATC1GSK3BDYRK1A
SCHEMBL20122760 0.88 ROCK2 (0.44) ROCK2CYP11B2METAP2CYP11B1
SCHEMBL30664257 0.88 ROCK2 (0.44) ROCK2CYP11B2METAP2CYP11B1
SCHEMBL30664163 0.88 METAP2 (0.41) ROCK2METAP2NFATC1GSK3BDYRK1A
SCHEMBL20122894 0.88 METAP2 (0.41) ROCK2METAP2NFATC1GSK3BDYRK1A
SCHEMBL20122763 0.87 ROCK2 (0.45) ROCK2CYP11B2METAP2DYRK1A

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 ROCK2 1093/4885CYP11B2 1286/4885METAP2 3515/4885
US-11130755-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders COL2A1, IDO1, COL1A1 ROCK2 1093/4885CYP11B2 1286/4885METAP2 3515/4885

“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.