SCHEMBL6684784

SCHEMBL6684784

CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cc(OC)ccc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 20/20 1.00
MTOR P42345 1/20 0.60
FKBP4 Q02790 1/20 0.60
FKBP5 Q13451 1/20 0.60

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
SCHEMBL5966173 0.97 FKBP1A (1.00) FKBP1AMTORFKBP4FKBP5
SCHEMBL12311521 0.83 FKBP1A (0.95) FKBP1AMTORFKBP4FKBP5
SCHEMBL5966011 0.82 FKBP1A (0.73) FKBP1AFKBP4FKBP5
SCHEMBL14920841 0.82 FKBP1A (1.00) FKBP1AFKBP4FKBP5
SCHEMBL14920840 0.82 FKBP1A (1.00) FKBP1AFKBP4FKBP5
SCHEMBL7400429 0.81 FKBP1A (1.00) FKBP1A
SCHEMBL5833651 0.80 FKBP1A (1.00) FKBP1AMTORFKBP4FKBP5
SCHEMBL7803438 0.80 FKBP1A (0.67) FKBP1AFKBP4FKBP5
SCHEMBL6604128 0.80 FKBP1A (1.00) FKBP1A
SCHEMBL16310218 0.80 FKBP1A (0.77) FKBP1AFKBP4FKBP5

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-1479373-A1 Hair growth compositions and uses GPI NIL Holdings, Inc. (US) 2004-11-24 EP disclosed