SCHEMBL17465995

SCHEMBL17465995

CCCCCCCCOC(=O)/C(C#N)=C/c1ccc(/C=C(\C#N)C(=O)OCCCCCCCC)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
DNM1 Q05193 3/20 0.51
TP53 P04637 1/20 0.49
MAPT P10636 5/20 0.46
POLB P06746 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 2/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MIF P14174 1/20 0.42
TSHR P16473 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
SCHEMBL22697175 0.96 ALDH1A1 (0.66) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL22697174 0.91 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL17466927 0.83 ALDH1A1 (0.82) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL7106944 0.82 DNM1 (0.57) ALDH1A1KMT2ADNM1TP53MAPT
SCHEMBL7106941 0.82 DNM1 (0.57) ALDH1A1KMT2ADNM1TP53MAPT
SCHEMBL17466000 0.82 TP53 (0.67) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL19829845 0.81 DNM1 (0.63) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL994759 0.81 DNM1 (0.60) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL994758 0.81 DNM1 (0.60) ALDH1A1MEN1KMT2ADNM1TP53
SCHEMBL8000911 0.80 TSHR (0.53) ALDH1A1MEN1KMT2ADNM1TP53

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9410035-B2 Modified heterophasic polyolefin composition MILLIKEN & COMPANY (US) 2016-08-09 US disclosed
US-9410035-B2 Modified heterophasic polyolefin composition MILLIKEN & COMPANY (US) 2016-08-09 US disclosed
US-20160024289-A1 MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION MILLIKEN & COMPANY 2016-01-28 US disclosed
US-20160024289-A1 MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION MILLIKEN & COMPANY 2016-01-28 US disclosed
WO-2016014122-A1 MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION MILLIKEN & COMPANY (US) 2016-01-28 WO disclosed