SCHEMBL7554246

SCHEMBL7554246

C#CCCCCC(C#CCCCC)CCC[CH2]

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HMGCR P04035 1/20 0.30

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
SCHEMBL5985617 0.83 HMGCR (0.36) HMGCR
SCHEMBL28567418 0.80 HMGCR (0.37) HMGCR
SCHEMBL5986403 0.80 HMGCR (0.33) HMGCR
SCHEMBL16240006 0.77 HMGCR (0.35) USP2CYP3A4SMN1; SMN2HMGCR
SCHEMBL6465519 0.75 PTPN7 (0.33) USP2SMN1; SMN2HMGCR
SCHEMBL7713668 0.75 TSHR (0.31)
SCHEMBL8649300 0.75 HMGCR (0.38) HMGCR
SCHEMBL15272802 0.74 TSHR (0.33)
SCHEMBL5984370 0.74 HMGCR (0.30) HMGCR
SCHEMBL61022 0.73 HMGCR (0.37) USP2CYP3A4SMN1; SMN2HMGCR

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-0938512-B1 POLYSILOXANE-CONTAINING POLYURETHANE ELASTOMERIC COMPOSITIONS AORTECH BIOMATERIALS PTY LTD (AU) 2002-06-26 EP disclosed