SCHEMBL27201396

SCHEMBL27201396

Nc1cc(N2CCCC(c3c[nH]c4ccccc34)C2)nc(N)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ATM Q13315 1/20 0.48
CYP2D6 P10635 1/20 0.43
HRH4 Q9H3N8 1/20 0.43
HSD11B1 P28845 1/20 0.42
HTR1A P08908 4/20 0.42
ADRA1D P25100 4/20 0.42
HTR2C P28335 2/20 0.41
ADRB2 P07550 1/20 0.41
BRD4 O60885 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
CREBBP Q92793 1/20 0.41
SLC6A4 P31645 1/20 0.40

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
SCHEMBL30834095 1.00 KDM4E (0.48) KDM4EATMCYP2D6HRH4HSD11B1
SCHEMBL30834227 0.87 HRH3 (0.50) KDM4EATMCYP2D6HRH4HSD11B1
SCHEMBL27201305 0.87 HRH3 (0.50) KDM4EATMCYP2D6HRH4HSD11B1
SCHEMBL30834081 0.81 HRH4 (0.43) HRH4
SCHEMBL27201423 0.81 HRH4 (0.43) HRH4
SCHEMBL27201295 0.78 HRH4 (0.42) HRH4
SCHEMBL30834067 0.72 MAP4K4 (0.58) HRH4
SCHEMBL27201397 0.72 MAP4K4 (0.58) HRH4
SCHEMBL10212688 0.71 KDM4E (0.84) KDM4EATMCYP2D6HSD11B1HTR1A
SCHEMBL30834075 0.71 CHRM2 (0.49) CYP2D6ALDH1A1

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 KDM4E 1293/4885ATM 1085/4885CYP2D6 3310/4885

“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.