SCHEMBL22808570

SCHEMBL22808570

CCO/C(=N\c1ccc(O)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 8/20 0.44
▸ ESR2 Q92731 5/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ NOS3 P29474 3/20 0.40
▸ NOS2 P35228 3/20 0.40
▸ NOS1 P29475 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ CHRM1 P11229 1/20 0.38

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
SCHEMBL18100322 0.88 ALDH1A1 (0.43) ALDH1A1MEN1NPC1KMT2AMAPT
SCHEMBL18100343 0.85 NOS3 (0.50) ALDH1A1MEN1NPC1KMT2AMAPT
SCHEMBL18100333 0.85 SLC22A2 (0.49) ALDH1A1MEN1NPC1KMT2AMAPT
SCHEMBL18100336 0.81 GAA (0.42) CA12CA1CA2CA9ALDH1A1
SCHEMBL11564425 0.81 NOS3 (0.46) ALDH1A1NPC1KMT2AMAPTNOS3
SCHEMBL18100304 0.81 ALDH1A1 (0.46) ESR1ESR2ALDH1A1MEN1KMT2A
SCHEMBL18100296 0.81 ALDH1A1 (0.46) ALDH1A1MEN1NPC1KMT2AMAPT
SCHEMBL10533056 0.80 LTA4H (0.49) CYP19A1GAATSHRTDP1
SCHEMBL10747714 0.80 TRPV1 (0.43) CA1CA2ALDH1A1MAPT
SCHEMBL10934519 0.79 CYP3A4 (0.43) ESR1ALDH1A1MEN1KMT2AMAPT

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-10871597-B2 Polarizing plate, image display device, and polarizing plate protective film FUJIFILM CORPORATION (JP) 2020-12-22 — — US disclosed
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