SCHEMBL19003065

SCHEMBL19003065

CCCC(C)(CC)CCO

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 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
SCHEMBL1100948 0.91 TSHR (0.35) ALDH1A1TSHRTDP1
SCHEMBL1099637 0.88 LMNA (0.39) LMNAHSD17B10ALDH1A1SMN1; SMN2TSHR
SCHEMBL497569 0.85
SCHEMBL598167 0.85 TSHR (0.40) LMNAHSD17B10ALDH1A1TSHRTDP1
SCHEMBL21044806 0.84 SMN1; SMN2 (0.46) LMNAHSD17B10ALDH1A1SMN1; SMN2TSHR
SCHEMBL5931192 0.83 LMNA (0.37) LMNAHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL7561689 0.80
SCHEMBL807052 0.80
SCHEMBL13649569 0.80
SCHEMBL598304 0.78

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-9688838-B1 Diisononyl terephthalate plasticizer and its use as well as process for producing the same NAN YA PLASTICS CORPORATION (TW) 2017-06-27 US claimed
US-9688838-B1 Diisononyl terephthalate plasticizer and its use as well as process for producing the same NAN YA PLASTICS CORPORATION (TW) 2017-06-27 US disclosed