SCHEMBL5700586

SCHEMBL5700586

CCC(C)(C)C(=O)C(=O)N1CCCC(CCCc2ccccc2)C1C(O)=S

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 13/20 0.60
MTOR P42345 1/20 0.50
FKBP4 Q02790 1/20 0.50
FKBP5 Q13451 1/20 0.50

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
SCHEMBL5700677 0.90 FKBP1A (0.49) FKBP1AMTORFKBP4FKBP5
SCHEMBL5700686 0.89 FKBP1A (0.47) FKBP1A
SCHEMBL5700674 0.88 FKBP1A (0.47) FKBP1A
SCHEMBL7605508 0.84 FKBP1A (0.60) FKBP1A
SCHEMBL5966060 0.84 FKBP1A (0.64) FKBP1AMTORFKBP4FKBP5
SCHEMBL19372465 0.83 FKBP1A (0.66) FKBP1A
SCHEMBL5966157 0.82 FKBP1A (0.60) FKBP1A
SCHEMBL4681434 0.81 FKBP1A (0.55) FKBP1A
SCHEMBL5700640 0.80 FKBP1A (0.67) FKBP1A
SCHEMBL5700676 0.80 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