SCHEMBL14280245

SCHEMBL14280245

COC1=CC(=CN=Nc2ccc([N+](=O)[O-])cc2)C=C(OC)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ TYR P14679 1/20 0.41
▸ PTGS2 P35354 4/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ MAPT P10636 4/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ F2 P00734 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ TNNI3 P19429 1/20 0.39
▸ TNNT2 P45379 1/20 0.39
▸ TNNC1 P63316 1/20 0.39
▸ KEAP1 Q14145 1/20 0.39

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
SCHEMBL14280247 0.84 KMT2A (0.45) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL14280270 0.82 TYR (0.46) MEN1KMT2ARAB9ANPC1TYR
SCHEMBL14280250 0.81 KMT2A (0.38) MEN1KMT2ATYRPTGS2PTGS1
SCHEMBL13760889 0.80 MEN1 (0.38) MEN1KMT2ARAB9ANPC1PTGS2
SCHEMBL22238634 0.80 MEN1 (0.38) MEN1KMT2ARAB9ANPC1PTGS2
SCHEMBL14253716 0.78 TYR (0.37) MEN1KMT2ARAB9ANPC1TYR
SCHEMBL14306630 0.78 TYR (0.41) MEN1KMT2ARAB9ANPC1TYR
SCHEMBL14280251 0.78 TYR (0.41) MEN1KMT2ANPC1TYRPTGS2
SCHEMBL14280246 0.76 ALDH1A1 (0.42) MEN1KMT2ARAB9ANPC1TYR
SCHEMBL18877788 0.76 MEN1 (0.35) MEN1KMT2ARAB9ANPC1PTGS2

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-7314692-B2 Phenylazomethylene-cyclohexadienone derivatives comprising electron withdrawing group and electrophotographic photoreceptor comprising the derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-01-01 — — US disclosed
US-7314692-B2 Phenylazomethylene-cyclohexadienone derivatives comprising electron withdrawing group and electrophotographic photoreceptor comprising the derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-01-01 — — US disclosed
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