SCHEMBL4381248

SCHEMBL4381248

Cc1cc(=O)oc2cc(OC(=O)Nc3ccc(F)c([N+](=O)[O-])c3)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MEN1 O00255 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 8/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
HPGD P15428 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HSD17B10 Q99714 2/20 0.53
GAA P10253 5/20 0.52
GLA P06280 4/20 0.52
CA12 O43570 4/20 0.52
CA9 Q16790 4/20 0.52
CA1 P00915 2/20 0.52
CTDSP1 Q9GZU7 2/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51

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
SCHEMBL4397314 0.84 KDM4E (0.56) KMT2ATDP1KDM4EALDH1A1NPC1
SCHEMBL4379921 0.81 ALPL (0.52) KMT2AMEN1TDP1KDM4EALDH1A1
SCHEMBL4385506 0.77 ALPL (0.58) KMT2AMEN1TDP1KDM4EALDH1A1
SCHEMBL4397568 0.77 MEN1 (0.51) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL119578 0.73 RAB9A (0.78) KMT2AMEN1TDP1KDM4EALDH1A1
SCHEMBL29780113 0.72 LMNA (0.63) KMT2AMEN1KDM4EALDH1A1RAB9A
SCHEMBL5881545 0.72 LMNA (0.63) KMT2AMEN1KDM4EALDH1A1RAB9A
SCHEMBL25497892 0.72 ALDH1A1 (0.58) KMT2AMEN1TDP1KDM4EALDH1A1
SCHEMBL335474 0.70 KDM4E (1.00) KMT2ATDP1KDM4EALDH1A1HPGD
SCHEMBL29651337 0.70 KDM4E (1.00) KMT2ATDP1KDM4EALDH1A1HPGD

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-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed