SCHEMBL31555367

SCHEMBL31555367

Cc1cc(-c2ccncc2)c(C)c(C)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 13/20 0.44
PDE3A Q14432 13/20 0.44
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 2/20 0.38
PDE5A O76074 1/20 0.38
TSHR P16473 1/20 0.38
PTGS1 P23219 1/20 0.38
PDE4A P27815 1/20 0.38
CYP2C19 P33261 1/20 0.38
BLM P54132 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
MEN1 O00255 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL10199342 0.82 ALDH1A1 (0.53) LMNAMAPTKDM4EHPGDALDH1A1
SCHEMBL15984750 0.75 NPC1 (0.44) PDE3BPDE3ALMNAMAPTKDM4E
SCHEMBL31441854 0.74 LMNA (0.44) PDE3BPDE3ALMNAMAPTKDM4E
SCHEMBL11470383 0.72 MAPT (0.55) PDE3BPDE3ALMNAMAPTKDM4E
SCHEMBL27546357 0.71 GRM4 (0.46) PDE3BPDE3ALMNAMAPTAURKB
SCHEMBL11125327 0.71 KDM4E (0.75) LMNAMAPTKDM4EHPGDALDH1A1
SCHEMBL16606388 0.70 ABCG2 (0.53) LMNAMAPTKDM4EHPGDALDH1A1
Iodide SCHEMBL31070281 0.69 GRM4 (0.45) PDE3BPDE3ALMNAMAPTAURKB
Iodide SCHEMBL9618573 0.69 GRM4 (0.45) PDE3BPDE3ALMNAMAPTAURKB
Hydrochloric Acid SCHEMBL29628896 0.69 GRM4 (0.45) PDE3BPDE3ALMNAMAPTAURKB

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-20250122402-A1 LONG SHELF-LIFE STABLE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS CONTAINING PYRIDINE LIGATED PALLADIUM COMPOUNDS PROMERUS, LLC (US) 2025-04-17 US disclosed