SCHEMBL24449652

SCHEMBL24449652

CCN(c1cc2ncccc2[nH]1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.44
MAPT P10636 1/20 0.42
SNCA P37840 1/20 0.42
DAO P14920 1/20 0.41
HRH4 Q9H3N8 1/20 0.36
KCNMA1 Q12791 1/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ACHE P22303 1/20 0.34
DRD3 P35462 1/20 0.33
TAAR1 Q96RJ0 2/20 0.33
AR P10275 1/20 0.33
DYRK1A Q13627 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL25775091 0.76 MAPT (0.56) ATAD2MAPTSNCADAOHRH4
SCHEMBL28761672 0.70 ATAD2 (0.50) ATAD2MAPTSNCADAOHRH4
SCHEMBL12677225 0.69 ATAD2 (0.53) ATAD2MAPTSNCADAOHRH4
SCHEMBL13469140 0.69 ATAD2 (0.53) ATAD2MAPTSNCADAOHRH4
SCHEMBL23806232 0.69 ATAD2 (0.49) ATAD2MAPTSNCADAOHRH4
SCHEMBL12873564 0.67 TAAR1 (0.36) MAPTCYP2D6TAAR1DYRK1A
SCHEMBL30053741 0.67 KDM5A (0.50) ATAD2MAPTSNCADAOHRH4
SCHEMBL3821084 0.67 ATAD2 (0.50) ATAD2MAPTSNCADAOHRH4
SCHEMBL22430460 0.67 ATAD2 (0.50) ATAD2MAPTSNCADAOHRH4
SCHEMBL30051860 0.67 DAO (0.46) ATAD2MAPTSNCADAOHRH4

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-20220162231-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-05-26 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-20220162231-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ACE, ACE2, PKD1 ATAD2 2454/4885MAPT 4226/4885SNCA 2761/4885

“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.