SCHEMBL27201356

SCHEMBL27201356

CC(C)c1cc(N2CCCC(n3c(=O)[nH]c4ccccc43)C2)nc(N)n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.48
HRH4 Q9H3N8 2/20 0.48
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
OPRM1 P35372 6/20 0.45
PLD1 Q13393 5/20 0.43
PLD2 O14939 3/20 0.43
OPRL1 P41146 2/20 0.42
FAAH O00519 2/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 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
SCHEMBL30834124 1.00 HRH3 (0.48) HRH3HRH4CHRM2CHRM4CHRM1
SCHEMBL30834075 0.88 CHRM2 (0.49) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL27201378 0.88 CHRM2 (0.49) CHRM2CHRM4CHRM1CHRM3OPRM1
SCHEMBL27201309 0.76 HRH3 (0.51) HRH3HRH4
SCHEMBL30885237 0.76 HRH3 (0.51) HRH3HRH4
SCHEMBL27201377 0.76 HRH4 (0.51) HRH3HRH4OPRM1OPRL1FAAH
SCHEMBL30834264 0.76 HRH4 (0.51) HRH3HRH4OPRM1OPRL1FAAH
SCHEMBL30834227 0.74 HRH3 (0.50) HRH3HRH4
SCHEMBL30885213 0.74 HRH3 (0.50) HRH3HRH4
SCHEMBL27201453 0.74 HRH3 (0.50) HRH3HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 US claimed
US-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS GID4, MDM2, XIAP HRH3 4300/4885HRH4 4074/4885CHRM2 4837/4885

“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.