SCHEMBL3516993

SCHEMBL3516993

CC(C)CCCC(C(=O)O)=C(C(=O)O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.38
KDM1A O60341 1/20 0.38
CA1 P00915 2/20 0.35
KDM4C Q9H3R0 2/20 0.35
KDM4A O75164 1/20 0.35
PHF8 Q9UPP1 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
THRB P10828 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
PTPN1 P18031 2/20 0.33
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 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
SCHEMBL3516367 0.88 CA1 (0.43) BLMCA1KDM4CKDM4APHF8
SCHEMBL3516372 0.88 CA1 (0.43) BLMCA1KDM4CKDM4APHF8
SCHEMBL10913154 0.85 BLM (0.45) BLMKDM1ACA1KDM4CKDM4A
SCHEMBL3518731 0.82 FNTA (0.47) CA1THRBFNTAFNTBPGGT1B
SCHEMBL3518737 0.82 FNTA (0.47) CA1THRBFNTAFNTBPGGT1B
SCHEMBL5611318 0.81 CA1 (0.44) BLMKDM1ACA1KDM4CKDM4A
SCHEMBL5611322 0.81 CA1 (0.44) BLMKDM1ACA1KDM4CKDM4A
SCHEMBL3513705 0.78 FNTA (0.58) THRBFNTAFNTBPGGT1BPTPN1
SCHEMBL3515208 0.78 FNTA (0.58) THRBFNTAFNTBPGGT1BPTPN1
SCHEMBL3513703 0.78 FNTA (0.58) THRBFNTAFNTBPGGT1BPTPN1

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-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed