SCHEMBL14543752

SCHEMBL14543752

CCCc1cc(C)c(C=O)o1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.33
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 0.31
STS P08842 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
SCHEMBL7333565 0.89 MAPT (0.37) TLR8MAPTSMN1; SMN2ALDH1A1ALOX15
SCHEMBL16670954 0.82 PON1 (0.31) KDM4EKMT2A
SCHEMBL31331625 0.78 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1KDM4E
Alcohol SCHEMBL28328944 0.73 MCL1 (0.33) ALDH1A1KDM4EHSD17B10
SCHEMBL3922006 0.73 TLR8 (0.37) TLR8MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6626531 0.72
SCHEMBL528110 0.71
SCHEMBL27946853 0.70 CA9 (0.34) MAPTSMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL1603208 0.68 ALDH1A1 (0.37) MAPTALDH1A1KDM4E
SCHEMBL6756326 0.67

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
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed