SCHEMBL4621297

SCHEMBL4621297

CCCC1(S)NC(=O)N(CC)C1=O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
F2 P00734 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
CTRC Q99895 1/20 0.34
GMNN O75496 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MGLL Q99685 1/20 0.31
CNR1 P21554 3/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL4622857 0.89 CNR1 (0.35) POLBF2ELANECTSGCTRC
SCHEMBL4620874 0.84 POLB (0.38) POLBF2ELANECTSGCTRC
SCHEMBL4619121 0.78 TSHR (0.39) LMNA
SCHEMBL4621742 0.78 POLB (0.33) POLBF2ELANECTSGCTRC
SCHEMBL4621001 0.77 CNR1 (0.40) POLBELANEMGLLCNR1
SCHEMBL23129557 0.76 FPR2 (0.39) POLBF2ELANECTSGCTRC
SCHEMBL24828775 0.74 ATM (0.42) POLBF2ELANECTSGCTRC
SCHEMBL1363086 0.74 POLB (0.43) POLBF2ELANECTSGCTRC
SCHEMBL4620473 0.73 CNR1 (0.36) POLBALDH1A1LMNACNR1KMT2A
SCHEMBL5584023 0.69 POLB (0.71) POLBF2ELANECTSGCTRC

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-1883454-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND Showa Denko K.K. (JP) 2008-02-06 EP disclosed
WO-2006126729-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO K.K. (JP) 2006-11-30 WO disclosed