SCHEMBL29472452

SCHEMBL29472452

COc1cc(C(F)(F)F)ccc1C(C)N

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
RAB9A P51151 1/20 0.43
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
CASR P41180 2/20 0.40
HTR2A P28223 2/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
CYP2D6 P10635 1/20 0.38

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
SCHEMBL17763832 1.00 PDE2A (0.44) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL26101015 0.86 L3MBTL1 (0.46) PDE2AL3MBTL1RAB9ACASRHTR2A
SCHEMBL13698776 0.86 PDE2A (0.46) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL29472437 0.83 PDE2A (0.60) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL18103190 0.83 PDE2A (0.44) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL22279132 0.83 PDE2A (0.60) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL22221150 0.81 L3MBTL1 (0.42) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL24653027 0.80 PDE2A (0.46) PDE2AL3MBTL1RAB9AALOX5APFEN1
SCHEMBL22221151 0.80 PDE2A (0.46) PDE2AL3MBTL1RAB9AALOX5APFEN1
Hydrochloric Acid SCHEMBL31137630 0.79 HTR2A (0.50) PDE2AL3MBTL1RAB9ACASRHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220098159-A1 CARBAMATE DERIVATIVES AND USES THEREOF NodThera Limited (GB) 2022-03-31 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-20220098159-A1 CARBAMATE DERIVATIVES AND USES THEREOF CASP1, IL1B, PYCARD PDE2A 900/4885L3MBTL1 4057/4885RAB9A 1603/4885

“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.