SCHEMBL4175889

SCHEMBL4175889

O=C1c2ccccc2C(=O)N1CCCc1cccc(/C=C/c2ccccc2-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CYP1B1 Q16678 2/20 0.45
ALDH1A1 P00352 1/20 0.42
ALDH2 P05091 1/20 0.42
PKM P14618 1/20 0.42
ALDH3A1 P30838 1/20 0.42
CASP3 P42574 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
NR1H3 Q13133 1/20 0.41
ACHE P22303 4/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL4175895 1.00 TDP1 (0.51) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4161344 0.86 TDP1 (0.48) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4161338 0.86 TDP1 (0.48) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4179087 0.84 TDP1 (0.46) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4179095 0.84 TDP1 (0.46) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4161460 0.83 TDP1 (0.45) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4172671 0.83 TDP1 (0.45) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4161468 0.83 TDP1 (0.45) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2
SCHEMBL4175190 0.83 NR1H3 (0.49) TDP1L3MBTL1CYP1B1ALDH1A1NR1H3
SCHEMBL4168828 0.83 TDP1 (0.45) TDP1L3MBTL1CYP1B1ALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10201545-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2019-02-12 US disclosed
US-9421210-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2016-08-23 US disclosed
US-20160193160-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ACUCELA INC. 2016-07-07 US disclosed
US-9314467-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2016-04-19 US disclosed
US-20150238497-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. 2015-08-27 US disclosed
US-20150166495-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ACUCELA INC. 2015-06-18 US disclosed
US-20150166494-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ACUCELA INC. 2015-06-18 US disclosed
US-8653142-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2014-02-18 US disclosed
US-20130253064-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. 2013-09-26 US disclosed
US-8420863-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ACUCELA, INC. (US) 2013-04-16 US disclosed
US-20120129860-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2012-05-24 US disclosed
EP-2076124-A2 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS Acucela, Inc. (US) 2009-07-08 EP disclosed
US-20090170841-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ACUCELA INC. (US) 2009-07-02 US disclosed
WO-2008131368-A2 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2008-10-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150166495-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20150166494-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20120129860-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20130253064-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20150238497-A1 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20160193160-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-10201545-B2 Styrenyl derivative compounds for treating ophthalmic diseases and disorders ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885
US-20090170841-A1 Styrenyl Derivative Compounds for Treating Ophthalmic Diseases and Disorders ALDH1A2, STARD3, TXNRD2 TDP1 272/4885L3MBTL1 1912/4885CYP1B1 2417/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.