SCHEMBL27201336

SCHEMBL27201336

Nc1nc(N2CCCC(c3ccn[nH]3)C2)c2sccc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.51
PRKCI P41743 1/20 0.43
LRRK2 Q5S007 1/20 0.41
PIK3CA P42336 6/20 0.39
MTOR P42345 5/20 0.39
KDM4E B2RXH2 2/20 0.38
PAK1 Q13153 2/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
PDE3B Q13370 1/20 0.37

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
SCHEMBL27201514 0.81 MAP4K4 (0.51) MAP4K4LRRK2KCNH2HRH4HRH3
SCHEMBL27201410 0.81 MAP4K4 (0.53) MAP4K4LRRK2ALDH1A1HPGDTSHR
SCHEMBL27201417 0.80 MAP4K4 (0.52) MAP4K4LRRK2PIK3CAMTORKCNH2
SCHEMBL27201579 0.79 MAP4K4 (0.53) MAP4K4LRRK2MTORKCNH2HRH4
SCHEMBL30885255 0.79 MAP4K4 (0.53) MAP4K4LRRK2MTORKCNH2HRH4
SCHEMBL27201635 0.77 MAP4K4 (0.51) MAP4K4LRRK2PIK3CAMTORHRH4
SCHEMBL30885232 0.77 MAP4K4 (0.51) MAP4K4LRRK2PIK3CAMTORHRH4
SCHEMBL27201470 0.77 MAP4K4 (0.48) MAP4K4LRRK2PDE4BKCNH2HRH4
SCHEMBL27201474 0.76 HRH4 (0.51) MAP4K4LRRK2KDM4EHRH4HRH3
SCHEMBL30885318 0.75 HRH4 (0.53) MAP4K4LRRK2HRH4PAK4

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 MAP4K4 1878/4885PRKCI 1977/4885LRRK2 209/4885

“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.