SCHEMBL26089720

SCHEMBL26089720

[CH2]C1CC2(C1)CN(Cc1ccccc1)C2

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
SIGMAR1 Q99720 1/20 0.48
CYP2D6 P10635 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
USP2 O75604 1/20 0.47
TSHR P16473 3/20 0.45
CYP3A4 P08684 3/20 0.43
FUCA1 P04066 2/20 0.43
ACHE P22303 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL8894586 0.82 FUCA1 (0.51) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL8892761 0.82 CYP2D6 (0.51) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL23727894 0.76 SIGMAR1 (0.54) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL3464617 0.76 CYP2D6 (0.61) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL31230946 0.76 CYP2D6 (0.61) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL15985246 0.74 CYP2D6 (0.60) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL31230966 0.74 CYP2D6 (0.59) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL14089988 0.74 MC4R (0.58) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL17706684 0.74 SIGMAR1 (0.52) GAASIGMAR1CYP2D6MEN1KMT2A
SCHEMBL14892774 0.73 DRD4 (0.59) GAASIGMAR1CYP2D6MEN1KMT2A

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-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-04-27 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-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE CHRM4, CHRM2, CHRM5 GAA 2002/4885SIGMAR1 343/4885CYP2D6 534/4885

“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.