SCHEMBL5282825

SCHEMBL5282825

CCC(C)(C)C(=O)C(=O)N1CCC(C[C@H](C)c2cccc3ccccc23)C1C(O)=S

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 14/20 0.40
RIPK1 Q13546 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
SCHEMBL5283096 0.87 FKBP1A (0.41) FKBP1ARIPK1
SCHEMBL5280408 0.87 FKBP1A (0.41) FKBP1ARIPK1
SCHEMBL5286046 0.80 FKBP1A (0.41) FKBP1ARIPK1
SCHEMBL5700676 0.80 FKBP1A (0.41) FKBP1ARIPK1
SCHEMBL5275386 0.80 FKBP1A (0.41) FKBP1ARIPK1
SCHEMBL5284378 0.79 FKBP1A (0.40) FKBP1A
SCHEMBL5274964 0.78 FKBP1A (0.38) FKBP1ARIPK1
SCHEMBL4676166 0.76 FKBP1A (0.44) FKBP1A
SCHEMBL5966027 0.72 FKBP1A (0.54) FKBP1A
SCHEMBL5700586 0.69 FKBP1A (0.60) FKBP1A

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-1626043-B1 Heterocyclic thioesters MGI GP INC (US) 2007-12-12 EP claimed
EP-1083873-B1 HETEROCYCLIC THIOESTER AND KETONE HAIR GROWTH COMPOSITIONS AND USES MGI GP INC (US) 2006-08-09 EP claimed