SCHEMBL18477019

SCHEMBL18477019

COC(=O)c1ccc2c(c1)nc(Cl)n2C1CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RPS6KB1 P23443 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.50
▸ IDH1 O75874 16/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ FGFR1 P11362 1/20 0.43

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
SCHEMBL19104435 0.82 IDH1 (0.69) IDH1
SCHEMBL17009727 0.82 IDH1 (0.69) IDH1
SCHEMBL20685199 0.82 IDH1 (0.69) IDH1
SCHEMBL20685200 0.82 IDH1 (0.69) IDH1
SCHEMBL17009724 0.82 IDH1 (0.69) IDH1
SCHEMBL17009721 0.82 IDH1 (0.69) IDH1
SCHEMBL21311021 0.81 RPS6KB1 (0.57) RPS6KB1KDM4EIDH1L3MBTL1
SCHEMBL19029395 0.80 KDM4E (0.56) KDM4EFGFR1
SCHEMBL20465152 0.79 RPS6KB1 (0.55) RPS6KB1KDM4EIDH1
SCHEMBL30158822 0.77 MEN1 (0.56) RPS6KB1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10829448-B2 Substituted benzoimidazoles as modulators of ROR-γ VITAE PHARMACEUTICALS, LLC (US) 2020-11-10 — — US disclosed
EP-3331876-B1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS LLC (US) 2020-10-07 — — EP disclosed
US-20200062707-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. 2020-02-27 — — US disclosed
WO-2017024018-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. (US) 2017-02-09 — — 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 (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-20200062707-A1 MODULATORS OF ROR-GAMMA RORB, RORC, RORA RPS6KB1 191/4885KDM4E 3259/4885IDH1 3584/4885
US-10829448-B2 Substituted benzoimidazoles as modulators of ROR-γ RORC, RORB, RORA RPS6KB1 401/4885KDM4E 1874/4885IDH1 988/4885

“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.

Send feedback