SCHEMBL7429157

SCHEMBL7429157

CCCC1(C(O)=S)C(c2ccccc2F)CCCN1C(=O)C(=O)C(C)(C)CC

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 13/20 0.39
RIPK1 Q13546 1/20 0.36

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
SCHEMBL6570607 0.89 FKBP1A (0.39) FKBP1ARIPK1
SCHEMBL6049184 0.84 RIPK1 (0.40) FKBP1ARIPK1
SCHEMBL7764589 0.81 DRD2 (0.36) FKBP1ARIPK1
SCHEMBL7761516 0.76 FKBP1A (0.40) FKBP1ARIPK1
SCHEMBL8485753 0.76 PSEN1 (0.35) FKBP1ARIPK1
SCHEMBL5700697 0.74 FKBP1A (0.33) FKBP1ARIPK1
SCHEMBL5280412 0.69 RIPK1 (0.37) FKBP1ARIPK1
SCHEMBL7429151 0.69 FKBP1A (0.47) FKBP1A
SCHEMBL4679856 0.69 FKBP1A (0.37) FKBP1ARIPK1
SCHEMBL5966081 0.68 FKBP1A (0.42) FKBP1ARIPK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002516844-A 2002-06-11 JP claimed
EP-1083873-A1 HETEROCYCLIC THIOESTER AND KETONE HAIR GROWTH COMPOSITIONS AND USES GPI NIL Holdings, Inc. (US) 2001-03-21 EP claimed
WO-1999062488-A1 HETEROCYCLIC THIOESTER AND KETONE HAIR GROWTH COMPOSITIONS AND USES GPI NIL HOLDINGS, INC. (US) 1999-12-09 WO claimed
EP-1127049-A1 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL Holdings, Inc. (US) 2001-08-29 EP disclosed
WO-2000016603-A2 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL HOLDINGS, INC. (US) 2000-03-30 WO disclosed