SCHEMBL13799182

SCHEMBL13799182

C=C/C(Br)=C\C=C(/N)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.41
▸ BLM P54132 2/20 0.35
▸ RECQL P46063 2/20 0.35
▸ F2 P00734 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ F12 P00748 1/20 0.35
▸ F7 P08709 1/20 0.35
▸ F3 P13726 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CES2 O00748 2/20 0.33

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
SCHEMBL6295220 0.77 AKT1 (0.43) AKT1BLMRECQLF2F10
SCHEMBL15683852 0.74 BLM (0.44) BLMRECQLF2F10F12
SCHEMBL14138447 0.72 BLM (0.43) AKT1BLMRECQLF2F10
SCHEMBL20619227 0.71 BLM (0.41) BLMRECQLF2F10F12
SCHEMBL15089130 0.71 BLM (0.41) BLMRECQLF2F10F12
SCHEMBL27534885 0.69 TDP1 (0.48) AKT1BLMRECQLF2F10
SCHEMBL4535484 0.69 F2 (0.48) BLMRECQLF2F10F12
SCHEMBL4713676 0.69 TDP1 (0.48) AKT1BLMRECQLF2F10
SCHEMBL19145357 0.68 ALDH1A1 (0.45) AKT1BLMRECQLF2F10
SCHEMBL11180392 0.68 AKT1 (0.52) AKT1BLMRECQLF2F10

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
WO-2009073245-A1 LIGHT-EMITTING ORGANOMETALLIC COMPLEXES UNIVERSAL DISPLAY CORPORATION (US) 2009-06-11 — — WO disclosed
Send feedback