SCHEMBL9013746

SCHEMBL9013746

CCN(CCC(=O)Oc1cccc(OC)c1)c1cccc(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GFER P55789 1/20 0.43
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
ACHE P22303 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
EGFR P00533 1/20 0.42

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
SCHEMBL11417448 0.84 GFER (0.51) MAPTSMN1; SMN2TP53POLBLMNA
SCHEMBL11506912 0.82 SMN1; SMN2 (0.50) MAPTSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL11670573 0.80 MTNR1A (0.46) MAPTSMN1; SMN2TP53POLBLMNA
SCHEMBL11136662 0.80 GFER (0.46) MAPTTP53LMNAALDH1A1HPGD
SCHEMBL6365445 0.79 MTNR1A (0.54) MAPTSMN1; SMN2LMNAALDH1A1HTT
SCHEMBL9349279 0.78 MTNR1A (0.53) SMN1; SMN2ALDH1A1TSHRMTNR1AMTNR1B
SCHEMBL7595655 0.78 KMT2A (0.45) LMNAALDH1A1MTNR1AMTNR1BACHE
SCHEMBL2068905 0.78 GFER (0.45) MAPTSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL397442 0.77 GFER (0.54) MAPTSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL11212465 0.77 TDP1 (0.45) MAPTSMN1; SMN2TP53LMNAALDH1A1

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-5550218-A DISPERSE DYES FOR DYEING OR PRINTING TEXTILE MATERIALS MADES OF NATURAL, SYNTHETIC OR SEMI-SYNTHETIC HYDROPHOBIC ORGANIC MATERIALS SANDOZ LTD. (CH) 1996-08-27 US disclosed