SCHEMBL2836898

SCHEMBL2836898

CCCCOCCc1ccccc1C(=O)NC(CC)c1ccc(F)c([Ti](C2=CC=CC2)(C2=CC=CC2)c2c(F)ccc(C(CC)NC(=O)c3ccccc3CCOCCCC)c2F)c1F

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
TSHR P16473 2/20 0.33
FAAH O00519 1/20 0.32
LMNA P02545 2/20 0.31
CCR1 P32246 1/20 0.31
GALR1 P47211 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL2832105 0.99 MEN1 (0.34) MEN1KMT2ANPSR1TSHRFAAH
SCHEMBL267592 0.85 PTPN1 (0.36) MEN1KMT2ATSHRLMNA
SCHEMBL266307 0.85 PTPN1 (0.36) MEN1KMT2ATSHRLMNA
SCHEMBL2833724 0.81 MEN1 (0.34) MEN1KMT2ANPSR1POLBSMN1; SMN2
SCHEMBL2837725 0.79 MEN1 (0.34) MEN1KMT2ANPSR1TSHRLMNA
SCHEMBL4600373 0.75
SCHEMBL483287 0.74 L3MBTL1 (0.35) MEN1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL9315519 0.70 PLA2G4B (0.32) FAAHALDH1A1
SCHEMBL267593 0.70 LPAR1 (0.32) KDM4E
SCHEMBL483355 0.70 ALDH1A1 (0.39) LMNAPOLBSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741005-B2 A planographic printing plate precursor comprising: an aluminum support; and a photosensitive layer including a polymerization initiator, a polymerizable compound and a binder polymer; an oxygen barrier layer; and a protective layer including a filler; capable of image formation FUJIFILM CORPORATION (JP) 2010-06-22 US disclosed
EP-1839853-B1 Planographic printing plate precursor and stack thereof FUJIFILM CORP (JP) 2009-07-08 EP disclosed
US-20070231740-A1 A planographic printing plate precursor comprising: an aluminum support; and a photosensitive layer including a polymerization initiator, a polymerizable compound and a binder polymer; an oxygen barrier layer; and a protective layer including a filler; capable of image formation FUJIFILM CORPORATION (JP) 2007-10-04 US disclosed
EP-1839853-A1 Planographic printing plate precursor and stack thereof FUJIFILM Corporation (JP) 2007-10-03 EP disclosed