SCHEMBL24435408

SCHEMBL24435408

CC(C)N1CCCC(c2ccc(CC(C)N3CCC(c4ccccc4)CC3)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.48
DRD3 P35462 3/20 0.48
KCNH2 Q12809 3/20 0.45
DRD1 P21728 1/20 0.44
DRD4 P21917 1/20 0.44
DRD5 P21918 1/20 0.44
ESRRG P62508 2/20 0.44
ESRRB O95718 1/20 0.44
ESR1 P03372 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
OPRM1 P35372 1/20 0.42
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
STAT1 P42224 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLC18A3 Q16572 1/20 0.40
UBE2M P61081 1/20 0.40
DCUN1D1 Q96GG9 1/20 0.40

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
SCHEMBL24434619 0.90 DRD2 (0.54) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL2603277 0.83 DRD2 (0.63) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL17658922 0.83 DRD2 (0.63) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL21323287 0.83 DRD2 (0.63) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL25456970 0.81 DRD2 (0.47) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL2603312 0.80 KCNH2 (0.61) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL12609029 0.80 HRH3 (0.56) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL12609017 0.80 HRH3 (0.56) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL2603285 0.80 HRH3 (0.56) DRD2DRD3KCNH2DRD1DRD4
SCHEMBL2603307 0.79 DRD2 (0.58) DRD2DRD3KCNH2DRD1DRD4

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G DRD2 4602/4885DRD3 4250/4885KCNH2 4653/4885

“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.