SCHEMBL21148868

SCHEMBL21148868

CC(C)OC(=O)C(N)(CC(C)(C)C)c1ccc2nc(-c3cnn(C(F)F)c3)ccc2c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 12/20 0.34
▸ FGFR2 P21802 12/20 0.34
▸ FGFR4 P22455 12/20 0.34
▸ FGFR3 P22607 12/20 0.34
▸ KDR P35968 12/20 0.34
▸ HSP90AA1 P07900 3/20 0.33
▸ FLT3 P36888 4/20 0.32
▸ MAOB P27338 2/20 0.32
▸ SYK P43405 1/20 0.32
▸ MAPT P10636 2/20 0.31

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
SCHEMBL20908298 1.00 FGFR1 (0.34) FGFR1FGFR2FGFR4FGFR3KDR
SCHEMBL21150320 0.83 MKNK1 (0.34) HSP90AA1
SCHEMBL20908295 0.80 MEN1 (0.32) —
SCHEMBL29640278 0.80 MEN1 (0.32) —
SCHEMBL28402032 0.80 MEN1 (0.32) —
SCHEMBL20907701 0.79 MEN1 (0.34) —
SCHEMBL23114938 0.75 KCNH2 (0.34) —
SCHEMBL20907705 0.75 KCNH2 (0.34) —
SCHEMBL20908241 0.75 POLQ (0.34) —
SCHEMBL23115147 0.75 POLQ (0.34) —

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-10774053-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2020-09-15 — — US disclosed
US-20190210978-A1 HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2019-07-11 — — 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-10774053-B2 HIV protease inhibitors PRSS1, SERPINB1, FURIN FGFR1 3083/4885FGFR2 4620/4885FGFR4 4058/4885
US-20190210978-A1 HIV PROTEASE INHIBITORS PRSS1, SERPINB1, HPN FGFR1 3306/4885FGFR2 4456/4885FGFR4 4102/4885

“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.

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