SCHEMBL20620249

SCHEMBL20620249

CC(C)(C)Nc1cc(F)cc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 3/20 0.49
EPAS1 Q99814 6/20 0.39
RAPGEF3 O95398 3/20 0.37
GRM4 Q14833 2/20 0.36
FDPS P14324 1/20 0.36
ACLY P53396 1/20 0.36
IDH1 O75874 1/20 0.35
MAOB P27338 1/20 0.34
HTT P42858 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
SCHEMBL8246728 0.84 RAPGEF4 (0.40) RAPGEF4ACLY
SCHEMBL8247975 0.84 FDPS (0.47) RAPGEF4FDPSACLY
SCHEMBL12764927 0.77 RAPGEF4 (0.44) RAPGEF4FDPS
SCHEMBL12135857 0.77 RAPGEF4 (0.44) RAPGEF4
SCHEMBL1638576 0.76 RAPGEF4 (0.53) RAPGEF4EPAS1RAPGEF3GRM4ACLY
SCHEMBL20620250 0.75 RAPGEF4 (0.49) RAPGEF4EPAS1GRM4IDH1MAOB
SCHEMBL21571898 0.73 EGFR (0.40) RAPGEF4GRM4IDH1
SCHEMBL9355733 0.73 MAOB (0.53) RAPGEF4GRM4MAOBHTT
SCHEMBL4185946 0.73 RAPGEF4 (0.50) RAPGEF4EPAS1GRM4ACLYMAOB
SCHEMBL360242 0.71 RAPGEF4 (0.48) RAPGEF4EPAS1GRM4ACLYMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10689331-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-23 US disclosed
US-20190002402-A1 IDO INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-01-03 US 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-20190002402-A1 IDO INHIBITORS IDO1, IDO2, INMT RAPGEF4 4382/4885EPAS1 985/4885RAPGEF3 3614/4885
US-10689331-B2 IDO inhibitors IDO1, IDO2, INMT RAPGEF4 4382/4885EPAS1 985/4885RAPGEF3 3614/4885

“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.