SCHEMBL23264653

SCHEMBL23264653

COc1ncc(C)c(N)c1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.38
MAPT P10636 3/20 0.36
CASP1 P29466 2/20 0.36
AURKA O14965 1/20 0.35
TTK P33981 1/20 0.35
AURKB Q96GD4 1/20 0.35
INCENP Q9NQS7 1/20 0.35
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 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
SCHEMBL21411447 0.82 MAPT (0.41) UHRF1MAPTCASP1AURKATTK
SCHEMBL14853026 0.82 MAPT (0.39) UHRF1MAPTCASP1AURKATTK
SCHEMBL29403152 0.79 MAPT (0.38) UHRF1MAPTCASP1AURKATTK
SCHEMBL14853023 0.79 MAPT (0.38) UHRF1MAPTCASP1AURKATTK
SCHEMBL22207280 0.78 PIK3CA (0.36) MAPTCASP1AURKATTKAURKB
SCHEMBL2790586 0.78 MAPT (0.35) MAPTCASP1AURKATTKAURKB
SCHEMBL22224634 0.76 HTT (0.37) MAPTCASP1AURKATTKAURKB
SCHEMBL29755825 0.75 AGXT (0.34) MAPTCASP1AURKATTKAURKB
SCHEMBL28812025 0.75 MAPT (0.42) UHRF1MAPTCASP1AURKATTK
SCHEMBL9275751 0.75 AGXT (0.34) MAPTCASP1AURKATTKAURKB

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-11524960-B2 Heterobicyclic inhibitors of MAT2A and methods of use for treating cancer SERVIER PHARMACEUTICALS LLC (US) 2022-12-13 US disclosed
US-20210115045-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER SERVIER PHARMACEUTICALS LLC 2021-04-22 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-20210115045-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER MAT2A, MAT2B, MAT1A UHRF1 1497/4885MAPT 1127/4885CASP1 4267/4885
US-11524960-B2 Heterobicyclic inhibitors of MAT2A and methods of use for treating cancer MAT2A, MAT2B, MAT1A UHRF1 1497/4885MAPT 1127/4885CASP1 4267/4885

“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.