SCHEMBL9681464

SCHEMBL9681464

Cc1nc2nc(N)nc(S)c2nc1C

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL2492949 0.77 DHFR (0.46) MAPTKDM4EALDH1A1LMNA
SCHEMBL30570888 0.74 MAPT (0.35) MAPTKDM4EALDH1A1LMNA
SCHEMBL2492490 0.74 MAPT (0.35) MAPTKDM4EALDH1A1LMNA
SCHEMBL11013578 0.71 NOS1 (0.49) MAPTKDM4EALDH1A1LMNA
SCHEMBL11012322 0.71 CCNA2 (0.39) MAPTKDM4EALDH1A1LMNA
SCHEMBL12261745 0.70 MAPT (0.31) MAPTKDM4EALDH1A1LMNA
SCHEMBL9313963 0.67 DHFR (0.41) MAPTKDM4EALDH1A1LMNA
SCHEMBL6824598 0.67 DHFR (0.41) MAPTKDM4EALDH1A1LMNA
Bromide SCHEMBL5860793 0.65 PIK3CG (0.40) MAPTKDM4EALDH1A1LMNA
SCHEMBL2494141 0.64 PIK3CG (0.33) MAPT

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
EP-0483426-A1 Thiol heterocyclic deodorant composition and method of deodorization THE PROCTER & GAMBLE COMPANY (US) 1992-05-06 EP claimed
EP-0483426-A1 Thiol heterocyclic deodorant composition and method of deodorization THE PROCTER & GAMBLE COMPANY (US) 1992-05-06 EP disclosed