SCHEMBL20122831

SCHEMBL20122831

COc1ccc(-c2cc(Cl)cc3c4ccncc4n(CC(F)(F)F)c23)cn1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.44
METAP2 P50579 4/20 0.42
RPS6KA3 P51812 1/20 0.41
GPBAR1 Q8TDU6 1/20 0.40
ROCK2 O75116 3/20 0.40
F2RL3 Q96RI0 5/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
AAK1 Q2M2I8 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
KDR P35968 1/20 0.36

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
SCHEMBL30664131 1.00 PIK3CA (0.44) PIK3CAMETAP2RPS6KA3GPBAR1ROCK2
SCHEMBL20122841 0.88 RPS6KA3 (0.41) PIK3CAMETAP2RPS6KA3GPBAR1ROCK2
SCHEMBL30664170 0.88 RPS6KA3 (0.41) PIK3CAMETAP2RPS6KA3GPBAR1ROCK2
SCHEMBL20122968 0.87 ROCK2 (0.40) METAP2ROCK2
SCHEMBL30664260 0.87 ROCK2 (0.40) METAP2ROCK2
SCHEMBL20122983 0.87 METAP2 (0.44) METAP2ROCK2
SCHEMBL30664139 0.87 METAP2 (0.44) METAP2ROCK2
SCHEMBL20122767 0.86 METAP2 (0.45) METAP2ROCK2AAK1
SCHEMBL30664166 0.86 METAP2 (0.45) METAP2ROCK2AAK1
SCHEMBL20122844 0.85 METAP2 (0.43) METAP2ROCK2

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 8 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-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-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 PIK3CA 1083/4885METAP2 3515/4885RPS6KA3 1437/4885
US-11130755-B2 Substituted pyrido[3,4-b]indoles for the treatment of cartilage disorders COL2A1, IDO1, COL1A1 PIK3CA 1083/4885METAP2 3515/4885RPS6KA3 1437/4885

“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.