SCHEMBL7635137

SCHEMBL7635137

CCCCCC[C](C)OOC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 2/20 0.50
▸ SCN1A P35498 3/20 0.47
▸ SCN2A Q99250 3/20 0.47
▸ SCN3A Q9NY46 3/20 0.47
▸ PTPN11 Q06124 2/20 0.45
▸ LTB4R2 Q9NPC1 4/20 0.45
▸ TSHR P16473 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ AGTR1 P30556 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7627482 0.83 SCN1A (0.52) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7627885 0.83 HDAC8 (0.48) TSHRALDH1A1LMNACNR1CNR2
SCHEMBL7628612 0.82 ALDH1A1 (0.48) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL7627740 0.82 LMNA (0.50) PTPN11TSHRALDH1A1LMNATP53
SCHEMBL7636618 0.81 POLB (0.52) SOAT1ALDH1A1LMNACES2CES1
SCHEMBL7625349 0.80 CES2 (0.55) TSHRALDH1A1LMNACES2CES1
SCHEMBL28003347 0.79 SOAT1 (0.58) SOAT1PTPN11LTB4R2ALDH1A1CNR1
SCHEMBL28743866 0.79 SOAT1 (0.58) SOAT1PTPN11LTB4R2ALDH1A1CNR1
SCHEMBL7633233 0.78 PTPN11 (0.47) PTPN11LTB4R2CNR1CNR2CES2
SCHEMBL7623584 0.78 SCN1A (0.47) SCN1ASCN2ASCN3AALDH1A1LMNA

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-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 — — EP disclosed
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