SCHEMBL25820160

SCHEMBL25820160

CC(C)Cc1ccnc2ccc(N3CCC(N)CC3)cc12

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 3/20 0.46
HTR6 P50406 8/20 0.44
HTR2B P41595 6/20 0.39
IP6K1 Q92551 2/20 0.38
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
MAP4K4 O95819 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
AKT2 P31751 1/20 0.36
ACVR1 Q04771 1/20 0.36
SSTR2 P30874 1/20 0.35

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
SCHEMBL25820104 0.86 IP6K1 (0.48) HRH4IP6K1MEN1GLAGAA
SCHEMBL25820106 0.86 IP6K1 (0.45) HRH4IP6K1MEN1GLAGAA
SCHEMBL25820121 0.85 MAP4K4 (0.49) HRH4IP6K1MEN1GLAGAA
SCHEMBL25820161 0.83 HRH4 (0.51) HRH4HTR2BMEN1GLAGAA
SCHEMBL25820118 0.83 HRH4 (0.35) HRH4HTR6HTR2BIP6K1MEN1
SCHEMBL25820105 0.83 CLK1 (0.44) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL25825849 0.82 HRH4 (0.42) HRH4HTR6HTR2BHRH3AKT2
SCHEMBL25820120 0.82 MEN1 (0.38) HRH4IP6K1MEN1GLAGAA
SCHEMBL25820165 0.80 IP6K1 (0.35) HRH4HTR2BIP6K1MEN1GLA
SCHEMBL25820116 0.79 MEN1 (0.34) HRH4HTR2BIP6K1MEN1GLA

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 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 (2 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 HRH4 2074/4885HTR6 2412/4885HTR2B 3066/4885
US-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA HRH4 2350/4885HTR6 2459/4885HTR2B 2588/4885

“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.