SCHEMBL10299607

SCHEMBL10299607

COC(OC)(C(=O)c1ccccc1OCCCCC(=O)O)c1ccccc1OCCCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.48
▸ KMT2A Q03164 3/20 0.47
▸ NPSR1 Q6W5P4 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ LMNA P02545 6/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CNR2 P34972 1/20 0.44
▸ MAPT P10636 4/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ NR1I2 O75469 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ HTR2B P41595 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ LTB4R Q15722 1/20 0.41

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
SCHEMBL5514981 0.76 ALDH1A1 (0.67) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL5145231 0.76 LMNA (0.68) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL4266953 0.76 LMNA (0.68) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL5512491 0.75 ALDH1A1 (0.65) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL19717846 0.75 ALDH1A1 (0.65) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL2517739 0.75 ALDH1A1 (0.65) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL6362758 0.74 LMNA (0.53) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL9698448 0.74 LTB4R (0.47) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL13545502 0.73 ALDH1A1 (0.61) ALDH1A1KMT2ANPSR1MEN1HIF1A
SCHEMBL28463565 0.73 ALDH1A1 (0.54) ALDH1A1KMT2ANPSR1MEN1HIF1A

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-8216353-B2 Photoinitiator is a benzyl ketal compound incorporating a pendent water-soluble group via an oxygen atom or a sulfur atom; exhibits a high photocuring sensitivity, specifically even to black ink, and is easily handled KONICA MINOLTA HOLDINGS, INC. (JP) 2012-07-10 — — US disclosed
US-20080241424-A1 Ink-jet ink and ink-jet recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2008-10-02 — — US disclosed
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