SCHEMBL17826973

SCHEMBL17826973

COc1ccc(-c2cccc(C)n2)c(OC)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.48
CCR8 P51685 1/20 0.48
BRD9 Q9H8M2 2/20 0.43
BRD7 Q9NPI1 2/20 0.43
NPC1 O15118 3/20 0.41
TP53 P04637 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CRHR1 P34998 1/20 0.39
TGFBR1 P36897 3/20 0.39
MAPK14 Q16539 1/20 0.39
ERN1 O75460 1/20 0.38
PDCD1LG2 Q9BQ51 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL9007764 0.80 BRD9 (0.41) BRD9BRD7POLBTDP1CRHR1
SCHEMBL22402292 0.78 GABRA1 (0.44) BRD9BRD7POLBTDP1TGFBR1
SCHEMBL17276010 0.78 BRD9 (0.56) BRD9BRD7NPC1RAB9ASMN1; SMN2
SCHEMBL31438401 0.78 BRD9 (0.56) BRD9BRD7NPC1RAB9ASMN1; SMN2
SCHEMBL18287242 0.77 TDP1 (0.45) BRD9BRD7NPC1RAB9ASMN1; SMN2
SCHEMBL22939929 0.77 CCR1 (0.48) CCR1CCR8NPC1TP53RAB9A
SCHEMBL13273322 0.77 BRD9 (0.40) BRD9BRD7NPC1TP53RAB9A
SCHEMBL8514010 0.77 SMN1; SMN2 (0.50) CCR1CCR8BRD9BRD7NPC1
SCHEMBL3560406 0.74 CCR1 (0.46) CCR1CCR8NPC1TP53RAB9A
SCHEMBL29687348 0.73

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
EP-2379535-B1 7-PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES ARRAY BIOPHARMA INC (US) 2016-06-15 EP disclosed