SCHEMBL30834075

SCHEMBL30834075

Nc1cc(N2CCCC(n3c(=O)[nH]c4ccccc43)C2)nc(N)n1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.49
CHRM4 P08173 2/20 0.49
CHRM1 P11229 2/20 0.49
CHRM3 P20309 1/20 0.49
OPRM1 P35372 8/20 0.43
OPRK1 P41145 7/20 0.43
OPRL1 P41146 7/20 0.43
SLC18A3 Q16572 1/20 0.43
OPRD1 P41143 2/20 0.43
FAAH O00519 2/20 0.43
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41

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
SCHEMBL27201378 1.00 CHRM2 (0.49) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL27201356 0.88 HRH3 (0.48) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL30834124 0.88 HRH3 (0.48) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL27201412 0.74 HRH4 (0.41) FAAH
SCHEMBL30834121 0.74 HRH4 (0.41) FAAH
SCHEMBL30834173 0.74 HRH4 (0.46) OPRM1OPRL1FAAH
SCHEMBL27201352 0.74 HRH4 (0.46) OPRM1OPRL1FAAH
SCHEMBL4084782 0.72 CHRM1 (0.76) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL3142425 0.72 CHRM1 (0.81) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL30834081 0.71 HRH4 (0.43)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 WO claimed
US-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 US disclosed
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 WO 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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS GID4, MDM2, XIAP CHRM2 4837/4885CHRM4 4785/4885CHRM1 4715/4885

“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.