SCHEMBL10180231

SCHEMBL10180231

CCC(C)c1ccc(COc2ccc(-c3ccccc3)cc2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 11/20 0.48
FFAR1 O14842 3/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
MAOB P27338 1/20 0.41
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
ADAMTS4 O75173 1/20 0.39
MMP13 P45452 1/20 0.39
HSP90AA1 P07900 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL14118337 0.79 BCHE (0.55) FFAR1NPC1RAB9AALDH1A1TSHR
SCHEMBL6721888 0.79 BCHE (0.55) FFAR1NPC1RAB9AALDH1A1TSHR
SCHEMBL10178709 0.78 FFAR1 (0.48) FFAR1ADAMTS4MMP13
SCHEMBL825567 0.77 ALDH1A1 (0.55) FFAR1NPC1RAB9AALDH1A1TSHR
SCHEMBL10178626 0.75 ALDH1A1 (0.41) NPC1RAB9AALDH1A1TSHRHSP90AA1
SCHEMBL825382 0.74 TSHR (0.42) ALDH1A1TSHR
SCHEMBL14461757 0.74 CCNB2 (0.50) FFAR1TSHRMAOB
SCHEMBL10178778 0.74 ALDH1A1 (0.40) FFAR1NPC1RAB9AALDH1A1TSHR
SCHEMBL16687011 0.73 GRIA4 (0.51) ALDH1A1TSHR
SCHEMBL3628638 0.73 GRIA4 (0.51) ALDH1A1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124310-B2 Positive resist composition and pattern forming method using the same FUJIFILM CORPORATION (JP) 2012-02-28 US disclosed
US-20090087784-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed