SCHEMBL24434722

SCHEMBL24434722

COc1ccc(CCC(C)C)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.42
ADRA1A P35348 1/20 0.42
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
POLB P06746 2/20 0.41
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
CYP19A1 P11511 1/20 0.41
ESR2 Q92731 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40

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
SCHEMBL12413786 0.84 GAA (0.49) TAAR1ADRA1AKDM1AMAOAMAOB
SCHEMBL29828865 0.79 TAAR1 (0.65) TAAR1ADRA1AMAOBMAPTMEN1
SCHEMBL9921244 0.79 TAAR1 (0.46) TAAR1ADRA1AKDM1AMAOAMAOB
SCHEMBL3318610 0.79 TAAR1 (0.65) TAAR1ADRA1AMAOBMAPTMEN1
SCHEMBL3677716 0.79 KDM1A (0.44) TAAR1ADRA1AKDM1AMAOAMAOB
SCHEMBL434483 0.79 IDO1 (0.46) MAOBKDM4EHTR2A
SCHEMBL13104388 0.79 ADRA1A (0.64) TAAR1ADRA1AALDH1A1HTR2A
SCHEMBL13499935 0.78 TAAR1 (0.37) TAAR1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL30639583 0.78 TAAR1 (0.62) TAAR1ADRA1AMAOBMAPTMEN1
SCHEMBL2337969 0.78 CYP2D6 (0.53) TAAR1ADRA1AKDM1AMAOAMAOB

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G TAAR1 4274/4885ADRA1A 4080/4885KDM1A 4411/4885

“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.