SCHEMBL4621096

SCHEMBL4621096

CCCN1C(=O)NC(S)(C(C)C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.35
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4620293 0.76 CNR1 (0.33) CNR1POLBRAB9A
SCHEMBL4618674 0.76 FPR2 (0.38) CNR1POLBRAB9A
SCHEMBL1362490 0.76 POLB (0.41) CNR1POLBRAB9ASMN1; SMN2
SCHEMBL4622057 0.75 TSHR (0.33)
SCHEMBL4620473 0.74 CNR1 (0.36) CNR1POLBRAB9A
SCHEMBL13753309 0.71 POLB (0.65) POLBSMN1; SMN2
SCHEMBL4621001 0.70 CNR1 (0.40) CNR1POLBRAB9ASMN1; SMN2
SCHEMBL1362195 0.69 POLB (0.38) CNR1POLBRAB9A
SCHEMBL8578499 0.69 CNR1 (0.31) CNR1
SCHEMBL4621315 0.68 FPR2 (0.37) CNR1POLBRAB9A

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