SCHEMBL14280247

SCHEMBL14280247

COC1=CC(=CN=Nc2cccc([N+](=O)[O-])c2)C=C(OC)C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ MEN1 O00255 6/20 0.45
▸ MAPT P10636 4/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ CCNT1 O60563 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
SCHEMBL14280245 0.84 MEN1 (0.45) KMT2AALDH1A1MEN1MAPTMAPK1
SCHEMBL14280239 0.81 KMT2A (0.44) KMT2AALDH1A1MEN1MAPTNPSR1
SCHEMBL14280250 0.79 KMT2A (0.38) KMT2AALDH1A1MEN1MAPTMAPK1
SCHEMBL14280246 0.74 ALDH1A1 (0.42) KMT2AALDH1A1MEN1MAPTNPC1
SCHEMBL14280270 0.73 TYR (0.46) KMT2AALDH1A1MEN1MAPTNPSR1
SCHEMBL1405487 0.72 TSHR (0.67) KMT2AALDH1A1MEN1MAPTNPSR1
SCHEMBL1405486 0.72 TSHR (0.67) KMT2AALDH1A1MEN1MAPTNPSR1
SCHEMBL18871110 0.72 KMT2A (0.45) KMT2AALDH1A1MEN1MAPTNPSR1
SCHEMBL14280271 0.72 ALDH1A1 (0.44) KMT2AALDH1A1MEN1MAPTMAPK1
SCHEMBL14280251 0.71 TYR (0.41) KMT2AALDH1A1MEN1MAPTMAPK1

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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