SCHEMBL6697562

SCHEMBL6697562

CN(CC1CCCN1)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.33
CYP2D6 P10635 2/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
FDPS P14324 1/20 0.33
MLNR O43193 1/20 0.33
ABCB11 O95342 1/20 0.33
EGFR P00533 1/20 0.33
FYN P06241 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRM5 P08912 1/20 0.33

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
SCHEMBL6692745 1.00 GHSR (0.33) GHSRCYP2D6CHRNB4CHRNA3MEN1
SCHEMBL6695910 1.00 GHSR (0.33) GHSRCYP2D6CHRNB4CHRNA3MEN1
SCHEMBL9121275 0.94 CYP2D6 (0.40) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL14380898 0.92 CYP2D6 (0.39) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL9119096 0.90 CYP2D6 (0.40) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL9122106 0.90 CYP2D6 (0.40) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL4154069 0.88 LMNA (0.43) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL10508135 0.86 FDPS (0.38) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL9824081 0.86 FDPS (0.38) GHSRCYP2D6MEN1ALDH1A1LMNA
SCHEMBL1401177 0.80

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023086432-A1 PRODRUGS OF NEUROSTEROID ANALOGS AND USES THEREOF EMORY UNIVERSITY (US) 2023-05-19 WO disclosed
CN-1777427-A Aminoheteroaryl compounds as protein kinase inhibitors SUGEN INC (US) 2006-05-24 CN disclosed
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors SUGEN, INC. 2004-09-23 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-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors MAP3K15, MAP3K20, MAP3K19 GHSR 3232/4885CYP2D6 3067/4885CHRNB4 3094/4885

“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.