SCHEMBL7057032

SCHEMBL7057032

C=CCN(CC=C)CCCCCCCCCCCO

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.31
OPRM1 P35372 2/20 0.31
OPRD1 P41143 2/20 0.31
OPRK1 P41145 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL2363740 1.00 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5399561 1.00 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3806768 1.00 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4411839 0.98 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL2363817 0.95 OPRM1 (0.34) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL2363335 0.95 OPRM1 (0.34) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL2363490 0.93 OPRM1 (0.35) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL2733647 0.90 ALDH1A1 (0.34) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3655351 0.87 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3060057 0.87 KDM4E (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1

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
EP-1105444-B1 LIQUID CRYSTAL POLYMERS QINETIQ LTD (GB) 2003-05-07 EP disclosed
US-6511612-B1 Cyclopolymerization of a diallylamine derivative containing pendant mesogenic groups; optical recording media QINETIQ LIMITED (GB) 2003-01-28 US disclosed
EP-1105444-A1 LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 2001-06-13 EP disclosed
WO-2000006666-A1 LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-02-10 WO disclosed