SCHEMBL25826543

SCHEMBL25826543

Cc1cc(Cc2ccc(C3OCCO3)nc2)c2cc(N3CCO[C@H](C)C3)ccc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 1/20 0.36
MAP3K7 O43318 2/20 0.34
SYK P43405 5/20 0.34
MET P08581 4/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CDK6 Q00534 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
DRD1 P21728 1/20 0.32
BRD4 O60885 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
SCHEMBL26310403 0.81 MAPT (0.47) CDK4CCND1CDK6TSHRMAPT
SCHEMBL25820145 0.77 SYK (0.38) MAP3K7SYKCDK4CCND1CDK6
SCHEMBL25826546 0.74 LMNA (0.46) MAP3K7SYKTSHRNPSR1ALDH1A1
SCHEMBL24003998 0.71 MAPT (0.44) TSHRNPSR1MAPT
SCHEMBL23999887 0.69 MAPT (0.59) TSHRMAPT
SCHEMBL25820149 0.66 LRRK2 (0.39) SYKCDK4CCND1CDK6
SCHEMBL26310405 0.66 MAPT (0.46) TSHRMAPT
SCHEMBL25820144 0.65 NPSR1 (0.48) TSHRNPSR1ALDH1A1HPGDMAPT
SCHEMBL26329876 0.64 LRRK2 (0.39) SYKTSHRNPSR1MAPTATM
SCHEMBL26329863 0.64 LRRK2 (0.44) SYK

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR WNT3A 496/4885MAP3K7 93/4885SYK 1886/4885

“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.