SCHEMBL30069844

SCHEMBL30069844

COC(=O)[C@@H]1CNC(Cc2cccc(C(F)(F)F)c2)=N1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.42
RAB9A P51151 3/20 0.42
KMT2A Q03164 2/20 0.42
NR3C2 P08235 1/20 0.42
POLB P06746 2/20 0.41
GPR52 Q9Y2T5 2/20 0.41
SCD O00767 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NR4A2 P43354 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.39
SMYD3 Q9H7B4 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL26440108 1.00 HTT (0.42) HTTRAB9AKMT2ANR3C2POLB
SCHEMBL949382 0.78 NAAA (0.43) KMT2ANR3C2ROCK2ROCK1MAPT
SCHEMBL4795172 0.78 SCD (0.43) HTTRAB9AKMT2ANR3C2POLB
SCHEMBL26440184 0.78 POLB (0.43) HTTRAB9AKMT2APOLBSCD
SCHEMBL30069894 0.78 SCD (0.43) HTTRAB9AKMT2ANR3C2POLB
SCHEMBL26440334 0.74 SIGMAR1 (0.45) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL26440123 0.71 S1PR1 (0.39) HTTKMT2APOLBSMN1; SMN2NR4A2
SCHEMBL30069736 0.71 S1PR1 (0.39) HTTKMT2APOLBSMN1; SMN2NR4A2
SCHEMBL2128961 0.67 MAOB (0.52) POLBSCDNR4A2MAPTMAOB
SCHEMBL30632615 0.67 HTT (0.60) HTTKMT2APOLBSMN1; SMN2ALDH1A1

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-20230131899-A1 INHIBITORS OF MICROBIALLY INDUCED AMYLOID AXIAL THERAPEUTICS, INC. (US) 2023-04-27 US disclosed
EP-4087560-A2 INHIBITORS OF MICROBIALLY INDUCED AMYLOID Axial Therapeutics, Inc. (US) 2022-11-16 EP 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-20230131899-A1 INHIBITORS OF MICROBIALLY INDUCED AMYLOID SNCA, PARK7, PRNP HTT 16/4885RAB9A 738/4885KMT2A 4786/4885

“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.