SCHEMBL6883843

SCHEMBL6883843

COc1cc(-c2ccc(N)c(OC)c2OC)c(OC)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.46
▸ CYP3A4 P08684 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ POLB P06746 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39

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
SCHEMBL3788843 0.82 ALDH1A1 (0.39) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL11792778 0.82 L3MBTL1 (0.56) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL29044238 0.76 CHEK1 (0.45) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL29046162 0.73 CHEK1 (0.46) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL28366576 0.73 ALDH1A1 (0.46) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL926329 0.73 L3MBTL1 (0.67) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL1122902 0.72 IDO1 (0.50) ALDH1A1CYP3A4HSD17B10TDP1TSHR
SCHEMBL31607667 0.72 ALDH1A1 (0.52) ALDH1A1CYP3A4HSD17B10TDP1POLB
SCHEMBL31607607 0.72 ALDH1A1 (0.52) ALDH1A1CYP3A4HSD17B10TDP1POLB
SCHEMBL5652687 0.70 ALDH1A1 (0.48) ALDH1A1CYP3A4HSD17B10TDP1TSHR

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-20040071594-A1 Oral self-assessment device UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-04-15 — — US disclosed
Send feedback