SCHEMBL17446285

SCHEMBL17446285

CCCN(CCC)[C@@H]1CCc2ccc(C)cc2C1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.72
DRD3 P35462 9/20 0.72
DRD4 P21917 5/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
HTR1A P08908 2/20 0.72
ADRB2 P07550 1/20 0.72
CYP2D6 P10635 1/20 0.72
CASP1 P29466 1/20 0.72
LMNA P02545 2/20 0.70
MAPT P10636 1/20 0.70
FYN P06241 1/20 0.64

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
SCHEMBL8689191 0.87 DRD3 (0.66) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL29448457 0.84 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL7449296 0.84 DRD2 (0.70) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL29460204 0.84 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL8930123 0.84 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL623950 0.84 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL7568447 0.84 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL7411429 0.84 DRD2 (0.70) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL6558764 0.84 DRD2 (0.70) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL7411424 0.84 DRD2 (0.70) DRD2DRD3DRD4MEN1KMT2A

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-20160015684-A1 COMPOSITIONS COMPRISING BIOREVERSIBLE DERIVATIVES OF HYDROXY N- SUBSTITUTED-2-AMINOTETRALINS, DOSAGE FORMS, AND RELATED METHODS SPRIASO LLC 2016-01-21 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-20160015684-A1 COMPOSITIONS COMPRISING BIOREVERSIBLE DERIVATIVES OF HYDROXY N- SUBSTITUTED-2-AMINOTETRALINS, DOSAGE FORMS, AND RELATED METHODS SLC7A1, CYP2D6, CYP3A7 DRD2 1602/4885DRD3 1564/4885DRD4 1742/4885

“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.