SCHEMBL5700677

SCHEMBL5700677

CCC(C)(C)C(=O)C(=O)N1CCCC(CCCc2cccc(F)c2)C1C(O)=S

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 13/20 0.49
MTOR P42345 1/20 0.46
FKBP4 Q02790 1/20 0.46
FKBP5 Q13451 1/20 0.46

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
SCHEMBL5700586 0.90 FKBP1A (0.60) FKBP1AMTORFKBP4FKBP5
SCHEMBL5700674 0.84 FKBP1A (0.47) FKBP1A
SCHEMBL5700686 0.81 FKBP1A (0.47) FKBP1A
SCHEMBL7537467 0.79 FKBP1A (0.52) FKBP1AFKBP4FKBP5
SCHEMBL5966060 0.79 FKBP1A (0.64) FKBP1AMTORFKBP4FKBP5
SCHEMBL7605508 0.77 FKBP1A (0.60) FKBP1A
SCHEMBL4677127 0.77 FKBP1A (0.66) FKBP1AMTORFKBP4FKBP5
SCHEMBL7938022 0.75 FKBP1A (0.65) FKBP1A
SCHEMBL5275386 0.75 FKBP1A (0.41) FKBP1AFKBP4FKBP5
SCHEMBL5700676 0.75 FKBP1A (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1083873-B1 HETEROCYCLIC THIOESTER AND KETONE HAIR GROWTH COMPOSITIONS AND USES MGI GP INC (US) 2006-08-09 EP claimed