SCHEMBL6674151

SCHEMBL6674151

CCCCCc1c(C#N)cc(I)c(Oc2c(I)cc(C#N)c(CCCCC)c2I)c1I

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
ALOX5 P09917 5/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
AR P10275 1/20 0.31

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
SCHEMBL28632561 0.71 TTR (0.39) MAPT
SCHEMBL10880958 0.71 MAPT (0.51) MAPTALDH1A1HPGDTSHRHSD17B10
SCHEMBL21585570 0.67 TYR (0.41) MAPTALDH1A1HPGDALOX5TSHR
SCHEMBL26313504 0.66 HSD17B10 (0.45) MAPTALDH1A1HPGDTSHRHSD17B10
SCHEMBL15097496 0.66 AR (0.40) MAPTALDH1A1HPGDALOX5TSHR
SCHEMBL4101867 0.64 MAPT (0.36) MAPTALDH1A1HPGDALOX5TSHR
SCHEMBL27779196 0.64 MAPT (0.42) MAPTALDH1A1HPGDHSD17B10
SCHEMBL8958355 0.64 MAPT (0.50) MAPTALDH1A1HPGDALOX5TSHR
SCHEMBL16416384 0.63 TSHR (0.44) MAPTALDH1A1HPGDALOX5TSHR
SCHEMBL2609819 0.63 TSHR (0.44) MAPTALDH1A1HPGDALOX5TSHR

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
WO-2004035012-A1 THE USE OF BIOMIMIC POLYMERS IN PERSONAL CARE COMPOSITIONS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-04-29 WO disclosed