SCHEMBL8208700

SCHEMBL8208700

CCCCCCCC/C=C\CCCCCCCCOCCc1ccccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.52
F3 P13726 3/20 0.52
MMP2 P08253 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
ALOX15 P16050 1/20 0.52
ECE1 P42892 1/20 0.52
SGMS1 Q86VZ5 1/20 0.52
SGMS2 Q8NHU3 1/20 0.52
MUS81 Q96NY9 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SAE1 Q9UBE0 1/20 0.52
BID P55957 3/20 0.49
BCL2L1 Q07817 3/20 0.49
MCL1 Q07820 3/20 0.49
BAK1 Q16611 3/20 0.49
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
PTPN11 Q06124 2/20 0.46

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
SCHEMBL8208704 1.00 F7 (0.52) F7F3MMP2KDM4EMAPT
SCHEMBL6140942 0.88 F7 (0.65) F7F3MMP2KDM4EMAPT
SCHEMBL9346061 0.88 F7 (0.65) F7F3MMP2KDM4EMAPT
SCHEMBL17530462 0.88 FOLH1 (0.51) KDM4ETSHRALDH1A1LMNAPTPN11
SCHEMBL28603851 0.85 BID (0.65) F7F3MMP2KDM4EMAPT
SCHEMBL16244982 0.82 FOLH1 (0.54) KDM4EALOX15TSHRALDH1A1LMNA
Phthalic Acid SCHEMBL21463032 0.82 ALDH1A1 (0.62) KDM4EMAPTALOX15HSD17B10TSHR
SCHEMBL9387945 0.82 BID (0.55) F7F3MMP2KDM4EMAPT
SCHEMBL7710667 0.80 KMT2A (0.63) KDM4EMAPTTSHRALDH1A1LMNA
SCHEMBL7710661 0.80 KMT2A (0.63) KDM4EMAPTTSHRALDH1A1LMNA

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
EP-0977725-A1 NEW FATTY ACID DERIVATIVES NORSK HYDRO ASA (NO) 2000-02-09 EP disclosed
WO-1998032718-A1 NEW FATTY ACID DERIVATIVES NORSK HYDRO ASA (NO) 1998-07-30 WO disclosed