SCHEMBL17200755

SCHEMBL17200755

C=C(C#N)C(=O)O.O=C(c1ccccc1)c1ccccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIG1 P18858 1/20 0.53
▸ GAA P10253 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ AKR1C3 P42330 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.43
▸ STS P08842 1/20 0.43
▸ HPGD P15428 4/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ HMGB1 P09429 1/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA6 P23280 1/20 0.43
▸ CA7 P43166 1/20 0.43

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
Benzophenone SCHEMBL2536126 0.85 ALDH1A1 (0.56) MEN1KMT2AUSP2AKR1C3ALDH1A1
Water SCHEMBL28094690 0.83 LIG1 (0.73) LIG1GAAMEN1KMT2AUSP2
SCHEMBL30661140 0.83 LIG1 (0.73) LIG1GAAMEN1KMT2AUSP2
Formaldehyde SCHEMBL588098 0.81 LIG1 (0.70) LIG1GAAMEN1KMT2AUSP2
SCHEMBL29390505 0.81 LIG1 (0.76) LIG1GAAMEN1KMT2AUSP2
Benzene SCHEMBL6034371 0.81 LIG1 (0.76) LIG1GAAMEN1KMT2AUSP2
SCHEMBL22129808 0.81 LIG1 (0.76) LIG1GAAMEN1KMT2AUSP2
SCHEMBL36215 0.81 LIG1 (0.76) LIG1GAAMEN1KMT2AUSP2
Methacrylic Acid SCHEMBL18986073 0.80 LIG1 (0.59) LIG1GAAMEN1KMT2AUSP2
SCHEMBL15815801 0.80 LIG1 (0.63) LIG1GAAMEN1KMT2AUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10807346-B2 Absorbing solar control interlayers PLEOTINT, L.L.C. (US) 2020-10-20 — — US disclosed
US-20170361577-A1 ABSORBING SOLAR CONTROL INTERLAYERS PLEOTINT, L.L.C. 2017-12-21 — — US disclosed
US-9776379-B2 Absorbing solar control interlayers PLEOTINT, L.L.C. (US) 2017-10-03 — — US disclosed
US-20150306848-A1 ABSORBING SOLAR CONTROL INTERLAYERS PLEOTINT, LLC 2015-10-29 — — US disclosed
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