SCHEMBL23700035

SCHEMBL23700035

O=C(c1cnn2c(=O)cc(-c3ccc(C4CCCCC4)cc3)[nH]c12)N1CCC(F)(F)C1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAT P00750 13/20 0.55
SPR P35270 1/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
FASN P49327 1/20 0.34
USP19 O94966 1/20 0.34
PIK3C3 Q8NEB9 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
SCHEMBL23700006 0.93 PLAT (0.52) PLATSPRHSP90AA1GAAMAPT
SCHEMBL23699974 0.88 PLAT (0.44) PLATHSP90AA1GAAMAPTKMT2A
SCHEMBL23699987 0.87 PLAT (0.50) PLATSPRHSP90AA1GAAMAPT
SCHEMBL23700017 0.85 PLAT (0.41) PLATHSP90AA1GAAMAPTKMT2A
SCHEMBL23700028 0.85 PLAT (0.45) PLATHSP90AA1GAAMAPTKMT2A
SCHEMBL23700013 0.83 PLAT (0.45) PLATHSP90AA1GAAMAPTKMT2A
SCHEMBL23707699 0.82 PLAT (0.54) PLATSPRHSP90AA1GAAMAPT
SCHEMBL23699979 0.82 PLAT (0.40) PLATSPRHSP90AA1GAAMAPT
SCHEMBL23700019 0.82 PLAT (0.40) PLATSPRHSP90AA1GAAMAPT
SCHEMBL23198888 0.81 PLAT (0.46) PLATHSP90AA1GAAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112204029-B Therapeutic compounds 豪夫迈·罗氏有限公司 2024-03-01 CN claimed
US-20210238184-A1 THERAPEUTIC COMPOUNDS GENENTECH, INC. (US) 2021-08-05 US claimed
CN-112204029-B Therapeutic compounds 豪夫迈·罗氏有限公司 2024-03-01 CN disclosed
US-20210238184-A1 THERAPEUTIC COMPOUNDS GENENTECH, INC. (US) 2021-08-05 US disclosed
US-20210238184-A1 THERAPEUTIC COMPOUNDS GENENTECH, INC. (US) 2021-08-05 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 (1 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-20210238184-A1 THERAPEUTIC COMPOUNDS YAP1, YES1, KRAS PLAT 3945/4885SPR 1589/4885HDAC1 1347/4885

“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.