SCHEMBL16346148

SCHEMBL16346148

O=C(O)NCc1cc2cc(-c3ccc(C(=O)N4CCC(F)(F)CC4)cc3)cc(-c3ccncc3)c2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 6/20 0.61
PAK4 O96013 2/20 0.61
PAK1 Q13153 1/20 0.61
CYP3A4 P08684 7/20 0.38
USP2 O75604 5/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
CYP2C19 P33261 4/20 0.38
HIF1A Q16665 3/20 0.38
MAPK1 P28482 2/20 0.38
FASN P49327 1/20 0.37
CYP2D6 P10635 4/20 0.36
CYP1A2 P05177 3/20 0.36
CYP2C9 P11712 3/20 0.36
LSS P48449 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LIPC P11150 1/20 0.36
CYP46A1 Q9Y6A2 2/20 0.35

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
SCHEMBL16345092 0.92 PAK4 (0.53) NAMPTPAK4PAK1CYP3A4USP2
SCHEMBL19066883 0.91 PAK4 (0.69) NAMPTPAK4PAK1FASNLIPC
SCHEMBL16345413 0.90 NAMPT (0.57) NAMPTPAK4PAK1FASNCYP46A1
SCHEMBL16379807 0.88 NAMPT (0.56) NAMPTPAK4PAK1CYP3A4FASN
SCHEMBL16345437 0.88 PAK4 (0.57) NAMPTPAK4PAK1SMN1; SMN2FASN
SCHEMBL18325898 0.88 PAK4 (0.54) NAMPTPAK4PAK1CYP3A4USP2
SCHEMBL16345912 0.86 PAK4 (0.54) NAMPTPAK4PAK1FASNALDH1A1
SCHEMBL29611700 0.86 PAK4 (0.54) NAMPTPAK4PAK1FASNALDH1A1
SCHEMBL18317520 0.85 PAK4 (0.53) NAMPTPAK4PAK1LIPCGABRA5
SCHEMBL19066870 0.85 PAK4 (0.59) NAMPTPAK4PAK1CYP3A4USP2

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 9 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
EP-3016946-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics, Inc. (US) 2016-05-11 EP disclosed
WO-2015003166-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. (US) 2015-01-08 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 (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 NAMPT 1663/4885PAK4 2007/4885PAK1 3040/4885
US-20180319779-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK NAMPT 1782/4885PAK4 2260/4885PAK1 3233/4885
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK NAMPT 1782/4885PAK4 2260/4885PAK1 3233/4885
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK NAMPT 1782/4885PAK4 2260/4885PAK1 3233/4885
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK NAMPT 1782/4885PAK4 2260/4885PAK1 3233/4885
US-20200102292-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK NAMPT 1782/4885PAK4 2260/4885PAK1 3233/4885

“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.