SCHEMBL24919733

SCHEMBL24919733

CC(C)[C@H](C)c1cnn(C)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.33
NAMPT P43490 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
IDO1 P14902 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
OPRM1 P35372 2/20 0.30
P2RX7 Q99572 1/20 0.30
OPRD1 P41143 1/20 0.30
IDH1 O75874 1/20 0.30
ALOX5AP P20292 1/20 0.30

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
SCHEMBL22768846 1.00 HRH3 (0.33) HRH3NAMPTGPR55GRNSORT1
SCHEMBL17000253 1.00 HRH3 (0.33) HRH3NAMPTGPR55GRNSORT1
SCHEMBL179280 0.81
SCHEMBL13010803 0.78 GRN (0.33) HRH3NAMPTGPR55GRNSORT1
SCHEMBL26643809 0.78 HRH3 (0.32) HRH3NAMPTGPR55GRNSORT1
SCHEMBL1752371 0.77
SCHEMBL20738488 0.77
SCHEMBL7982035 0.77
SCHEMBL28802900 0.77
SCHEMBL4929810 0.77

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-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS ARCUS BIOSCIENCES, INC. 2023-01-26 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-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS PIK3CA, PIK3CG, PIK3CD HRH3 2773/4885NAMPT 864/4885GPR55 921/4885

“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.