SCHEMBL23032152

SCHEMBL23032152

CC(C)(C)N1CC(CC(C)(C)N2CCc3ccccc3C2)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
ACHE P22303 1/20 0.36
MAPT P10636 2/20 0.36
TAAR1 Q96RJ0 2/20 0.36
LMNA P02545 1/20 0.36
NOTUM Q6P988 1/20 0.36
CARM1 Q86X55 1/20 0.35
DRD2 P14416 5/20 0.35
PHGDH O43175 1/20 0.35
MGLL Q99685 1/20 0.35
RIPK1 Q13546 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL23868392 0.81 ALDH1A1 (0.37) MAOAMAOBACHEMAPTTAAR1
SCHEMBL861951 0.79 MAOA (0.57) MAOAMAOBMAPTTAAR1LMNA
SCHEMBL20078475 0.78 MAOA (0.55) MAOAMAOBMAPTTAAR1NOTUM
SCHEMBL2617033 0.77 MAOA (0.50) MAOAMAOBMAPTTAAR1LMNA
SCHEMBL4666005 0.75 MAOA (0.48) MAOAMAOBMAPTTAAR1LMNA
SCHEMBL25136802 0.74 MAOA (0.47) MAOAMAOBMAPTTAAR1LMNA
SCHEMBL12558561 0.74 DRD2 (0.52) MAOAMAOBNOTUMCARM1DRD2
SCHEMBL19955090 0.73 MAOA (0.46) MAOAMAOBMAPTTAAR1LMNA
SCHEMBL24596137 0.72 ATM (0.31)
SCHEMBL25931329 0.71 OPRM1 (0.32) MAOAMAOBACHEMAPTTAAR1

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-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2021-02-25 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-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF TACR1, TACR2, GPBAR1 MAOA 676/4885MAOB 657/4885ACHE 1501/4885

“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.