SCHEMBL25058849

SCHEMBL25058849

N#CC(C(N)=O)=C1c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 3/20 0.40
▸ LCK P06239 1/20 0.40
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ BRCA1 P38398 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ YWHAG P61981 1/20 0.39
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAOA P21397 4/20 0.37
▸ TYR P14679 3/20 0.37
▸ MAOB P27338 3/20 0.37
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35

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
SCHEMBL25058875 0.83 EGFR (0.42) EGFRLCKMEN1KMT2AHSD17B10
SCHEMBL25058843 0.79 MAPT (0.46) MEN1KMT2AMAPTALDH1A1RECQL
SCHEMBL23209610 0.79 KMT2A (0.36) EGFRMEN1KMT2APOLBBRCA1
SCHEMBL25058840 0.77 IDO1 (0.45) EGFRLCKMEN1KMT2APOLB
SCHEMBL25058881 0.74 NR3C1 (0.41) MAOBMAPTALDH1A1RAB9ACYP3A4
SCHEMBL25058845 0.72 MAPT (0.41) KMT2APOLBMAOBMAPTALDH1A1
SCHEMBL25058856 0.70 ALDH1A1 (0.39) EGFRMEN1KMT2ABRCA1HSD17B10
SCHEMBL21315444 0.68 ALDH1A1 (0.38) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL8845448 0.67 MEN1 (0.43) MEN1KMT2APOLBBRCA1HSD17B10
SCHEMBL20099452 0.66 CRHBP (0.44) MEN1KMT2APOLBMAOATYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219632-A2 POLYMERIZABLE ABSORBERS OF UV AND HIGH ENERGY VISIBLE LIGHT Johnson & Johnson Vision Care, Inc. (US) 2023-08-02 — — EP disclosed
EP-3759171-B9 AN OPHTHALMIC DEVICE COMPRISING POLYMERIZABLE ABSORBERS OF UV AND HIGH ENERGY VISIBLE LIGHT JOHNSON & JOHNSON VISION CARE (US) 2023-05-24 — — EP disclosed
EP-3759171-B1 AN OPHTHALMIC DEVICE COMPRISING POLYMERIZABLE ABSORBERS OF UV AND HIGH ENERGY VISIBLE LIGHT JOHNSON & JOHNSON VISION CARE (US) 2023-02-22 — — EP disclosed
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