SCHEMBL18317602

SCHEMBL18317602

CN(C(=O)O)c1coc2c(Cl)cc(-c3ccc(C(=O)N4CCC(F)(F)CC4)cn3)cc12

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GABRA5 P31644 2/20 0.40
▸ PAK4 O96013 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.36
▸ HTR1A P08908 6/20 0.36
▸ HPGD P15428 3/20 0.35
▸ ADRA1A P35348 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL18325952 0.85 GABRA5 (0.42) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL16346873 0.83 PAK4 (0.44) GABRA5PAK4LRRK2HTR1A
SCHEMBL16345168 0.83 PAK4 (0.43) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL29611543 0.83 PAK4 (0.41) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL16345086 0.83 PAK4 (0.41) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL28730051 0.81 LRRK2 (0.42) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL18329053 0.79 PAK4 (0.42) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL29999947 0.79 PAK4 (0.42) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL31622713 0.78 GABRA5 (0.45) GABRA5PAK4LRRK2HTR1AHPGD
SCHEMBL18530652 0.77 PAK4 (0.38) GABRA5PAK4LRRK2HTR1AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2021-12-30 — — US disclosed
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2021-05-18 — — US disclosed
US-20200102292-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2020-04-02 — — US disclosed
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2019-09-03 — — US disclosed
US-20180319779-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2018-11-08 — — US disclosed
US-9856241-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2018-01-02 — — US disclosed
US-20160368904-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2016-12-22 — — US 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 (6 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-20160368904-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK GABRA5 55/4885PAK4 2007/4885LRRK2 2752/4885
US-20180319779-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK GABRA5 48/4885PAK4 2260/4885LRRK2 2579/4885
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK GABRA5 48/4885PAK4 2260/4885LRRK2 2579/4885
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK GABRA5 48/4885PAK4 2260/4885LRRK2 2579/4885
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK GABRA5 48/4885PAK4 2260/4885LRRK2 2579/4885
US-20200102292-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK GABRA5 48/4885PAK4 2260/4885LRRK2 2579/4885

“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.

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