SCHEMBL13747749

SCHEMBL13747749

CCOC(OCC)(P=O)c1ccc(C2(c3ccc(CP(=O)(OCC)OCC)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 1/20 0.35
▸ CCNT1 O60563 1/20 0.34
▸ CDK9 P50750 1/20 0.34
▸ PTK2 Q05397 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32

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
SCHEMBL13321996 0.71 — —
SCHEMBL14558948 0.71 HDAC1 (0.32) NPY5RHDAC1
SCHEMBL14558950 0.69 NPY5R (0.32) NPY5RCCNT1CDK9HDAC1
SCHEMBL14558943 0.67 NPY5R (0.31) NPY5R
SCHEMBL28205756 0.66 KCNN4 (0.36) KDM4EMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL13989153 0.66 HDAC1 (0.38) NPY5RCCNT1CDK9PTK2MAPT
SCHEMBL3375825 0.66 TSHR (0.50) NPY5RCCNT1CDK9PTK2MAPT
SCHEMBL13321995 0.66 KDM4E (0.36) NPY5RKDM4ELMNAMAPT
SCHEMBL22921004 0.66 EPHX2 (0.42) NPY5RCCNT1CDK9MEN1LMNA
SCHEMBL13981576 0.65 NPY5R (0.42) NPY5RCCNT1CDK9PTK2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090206742-A1 ORGANIC LIGHT-EMITTING ELEMENT YAMAGATA PROMOTIONAL ORGANIZATION FOR INDUSTRIAL TECHNOLOGY 2009-08-20 — — US disclosed
Send feedback