SCHEMBL23344745

SCHEMBL23344745

CCCC(C)(CC)N1CCN(C)c2ncccc21

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
GAA P10253 4/20 0.36
TP53 P04637 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
MAPT P10636 1/20 0.34
EPHX2 P34913 1/20 0.33
HSD11B1 P28845 2/20 0.32
DRD2 P14416 2/20 0.32
CHIA Q9BZP6 1/20 0.32
HTR1A P08908 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL23344744 0.79 GAA (0.41) POLBGAATP53SMN1; SMN2MAPT
SCHEMBL24342186 0.72 GAA (0.47) POLBGAATP53SMN1; SMN2MAPT
SCHEMBL24278468 0.70 GAA (0.38) POLBGAATP53SMN1; SMN2MAPT
SCHEMBL22313607 0.66 GAA (0.43) POLBGAATP53SMN1; SMN2MAPT
SCHEMBL21475765 0.66 LTA4H (0.33)
SCHEMBL22652330 0.65 NAMPT (0.40) ADRA2AADRA2BADRA2CDRD2
SCHEMBL25569654 0.64 GRIA2 (0.43) POLBGAATP53SMN1; SMN2ADRA2A
SCHEMBL25629019 0.64 GAA (0.41) POLBGAATP53SMN1; SMN2MAPT
SCHEMBL24597086 0.64 GRM5 (0.33) ADRA2AADRA2BADRA2CCHIA
SCHEMBL178982 0.64 GAA (0.45) POLBGAATP53SMN1; SMN2ADRA2A

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-20210139517-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF Revolution Medicines, Inc. 2021-05-13 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-20210139517-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF SOST, SOS1, SOS2 POLB 3902/4885GAA 990/4885TP53 2038/4885

“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.