SCHEMBL19892479

SCHEMBL19892479

COC(=O)c1ccc(C[n+]2ccc(-c3cc[n+](CCC[n+]4ccc(-c5cc[n+](Cc6ccc(C(=O)OC)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.54
▸ CYP4A11 Q02928 2/20 0.49
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ CYP4F2 P78329 1/20 0.48
▸ ACHE P22303 2/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CA1 P00915 4/20 0.45
▸ CA2 P00918 4/20 0.45
▸ CA12 O43570 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ CA14 Q9ULX7 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ CHKA P35790 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CA7 P43166 1/20 0.42

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
SCHEMBL16996823 0.94 PKM (0.59) PKMCYP4A11LOXL2CYP4F2ACHE
SCHEMBL18775300 0.88 PKM (0.68) PKMLOXL2NPC1RAB9ACA1
SCHEMBL20143524 0.83 PKM (0.50) PKMCYP4A11LOXL2ACHENPC1
Bromide SCHEMBL19534955 0.83 PKM (0.53) PKMCYP4A11LOXL2ACHENPC1
SCHEMBL18775295 0.81 PKM (0.48) PKMCYP4A11LOXL2CYP4F2ACHE
SCHEMBL19888147 0.80 PKM (0.47) PKMCYP4A11LOXL2CYP4F2ACHE
SCHEMBL19607242 0.80 PKM (0.49) PKMCYP4A11LOXL2CYP4F2ACHE
SCHEMBL19102931 0.79 PKM (0.46) PKMLOXL2ACHECA1CA2
SCHEMBL19102949 0.79 PKM (0.46) PKMLOXL2ACHECA1CA2
SCHEMBL19888149 0.79 PKM (0.48) PKMCYP4A11LOXL2CYP4F2ACHE

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-10444588-B2 Electrochromic element, optical filter, lens unit, imaging apparatus, and window member CANON KABUSHIKI KAISHA (JP) 2019-10-15 — — US disclosed
US-20180052375-A1 ELECTROCHROMIC ELEMENT, OPTICAL FILTER, LENS UNIT, IMAGING APPARATUS, AND WINDOW MEMBER CANON KABUSHIKI KAISHA (JP) 2018-02-22 — — US disclosed
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