SCHEMBL18925848

SCHEMBL18925848

CC(C)(C)Oc1cc(Oc2cc(OC(C)(C)C)cc(OC(C)(C)C)c2)cc(Oc2cc(OC(C)(C)C)cc(OC(C)(C)C)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.33
▸ RIPK1 Q13546 1/20 0.33
▸ ST14 Q9Y5Y6 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ ELANE P08246 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
SCHEMBL3818720 0.91 ALDH1A1 (0.39) KIF11ALDH1A1RIPK1
SCHEMBL18925849 0.90 HSP90AA1 (0.41) KIF11ALDH1A1
SCHEMBL9789782 0.80 GABRA1 (0.42) KIF11ALDH1A1SMN1; SMN2NPC1MAPT
SCHEMBL14075676 0.80 ALDH1A1 (0.61) ALDH1A1
SCHEMBL15341308 0.80 ALDH1A1 (0.37) KIF11ALDH1A1RIPK1SMN1; SMN2MAPK1
SCHEMBL9647184 0.78 KIF11 (0.37) KIF11ALDH1A1RIPK1
SCHEMBL15344308 0.78 KIF11 (0.33) KIF11ALDH1A1RIPK1
SCHEMBL2154864 0.78 ALDH1A1 (0.41) KIF11ALDH1A1RIPK1ST14SMN1; SMN2
SCHEMBL3786242 0.78 TSHR (0.35) KIF11ALDH1A1RIPK1MAPT
SCHEMBL31179930 0.78 KIF11 (0.33) KIF11ALDH1A1RIPK1

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
US-20170162904-A1 ADDITIVE FOR ELECTROCHEMICAL ELEMENT, ELECTROLYTE COMPRISING SAME, ELECTRODE, AND ELECTROCHEMICAL ELEMENT LG CHEM, LTD. (KR) 2017-06-08 — — US disclosed
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