Sugi Predict

Sugi Predict / Compounds / SCHEMBL5700640

SCHEMBL5700640

SCHEMBL5700640

CCC(C)(C)C(=O)C(=O)N1CCCCC1CCCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 13/20 0.67
▸ MEN1 O00255 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ KMT2A Q03164 1/20 0.56

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
SCHEMBL5700650 0.97 FKBP1A (0.66) FKBP1A
SCHEMBL19372465 0.97 FKBP1A (0.66) FKBP1A
SCHEMBL20180046 0.85 FKBP1A (0.53) FKBP1A
SCHEMBL19367186 0.82 FKBP1A (0.62) FKBP1A
SCHEMBL19367191 0.82 FKBP1A (0.62) FKBP1A
SCHEMBL18510347 0.82 FKBP1A (0.62) FKBP1A
SCHEMBL7458418 0.82 FKBP1A (0.60) FKBP1A
SCHEMBL7395994 0.82 FKBP1A (0.67) FKBP1AKMT2A
SCHEMBL7430411 0.82 FKBP1A (0.54) FKBP1AMEN1NPC1RAB9AKMT2A
SCHEMBL7395654 0.82 FKBP1A (0.68) 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-1083873-B1 HETEROCYCLIC THIOESTER AND KETONE HAIR GROWTH COMPOSITIONS AND USES MGI GP INC (US) 2006-08-09 — — EP claimed
US-6274602-B1 ADMINISTERING COMPOSTITIONS SUCH AS 3,3-DIMETHYL-1-((2S)-2-(5-(3-PYRIDYL) PENTANOYL)-1-PYRROLIDINE)-1, 2-PENTANEDIONE TO TREAT ALOPECIA OR PROMOTING HAIR GROWTH IN ANIMALS GPI NIL HOLDINGS, INC. 2001-08-14 — — US claimed