SCHEMBL14028583

SCHEMBL14028583

C=CCOCCOc1ccc(C(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ HRH3 Q9Y5N1 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ POLB P06746 2/20 0.41
▸ APP P05067 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ AOC3 Q16853 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ XBP1 P17861 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL8755135 0.90 ALDH1A1 (0.48) KMT2AMEN1KDM4ESMN1; SMN2POLB
SCHEMBL6232531 0.84 SMN1; SMN2 (0.50) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL18222955 0.81 KMT2A (0.50) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL28779833 0.81 KDM4E (0.50) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL14004238 0.80 RARB (0.41) KDM4EHRH3SMN1; SMN2TP53ALDH1A1
SCHEMBL11789508 0.79 KDM4E (0.49) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL9588954 0.79 ALDH1A1 (0.54) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL1527681 0.79 KDM4E (0.51) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL15581380 0.77 MEN1 (0.50) KMT2AMEN1KDM4EHRH3SMN1; SMN2
SCHEMBL12391999 0.77 MEN1 (0.50) KMT2AMEN1KDM4EHRH3SMN1; SMN2

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-7438830-B2 Mixtures for producing transparent plastics, transparent plastics, method for producing the same and the use thereof ROEHM GMBH & CO. KG (DE) 2008-10-21 — — US disclosed
US-7419619-B2 Mixtures for producing transparent plastics, transparent plastics and method for their production and use ROEHM GMBH & CO. KG (DE) 2008-09-02 — — US disclosed
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