SCHEMBL5197231

SCHEMBL5197231

C[C](C(C)C)C(C)CCC(C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.34
CA1 P00915 1/20 0.31
TSHR P16473 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
SCHEMBL482703 0.75 BLM (0.42) BLMCA1TSHR
SCHEMBL20490060 0.71 BLM (0.44) BLMCA1
SCHEMBL1784505 0.71 BLM (0.44) BLMCA1
Hydrogen Peroxide SCHEMBL9341267 0.69 TSHR (0.46) BLMCA1TSHR
SCHEMBL4452909 0.69
SCHEMBL16469013 0.69
SCHEMBL15197953 0.69 BLM (0.43) BLMCA1
SCHEMBL83493 0.69
SCHEMBL106833 0.67 ALDH1A1 (0.38) BLMCA1TSHR
SCHEMBL4821124 0.67 BLM (0.32) BLM

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-1844042-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-10-17 EP disclosed
WO-2006076529-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2006-07-20 WO disclosed