SCHEMBL18325836

SCHEMBL18325836

CCc1cc2cc(-c3ccc(C(=O)N4CCC(F)(F)CC4)cn3)cc(-c3ccc4cnccc4c3)c2o1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 2/20 0.54
NAMPT P43490 2/20 0.45
PAK1 Q13153 1/20 0.45
FASN P49327 1/20 0.43
PRMT3 O60678 1/20 0.41
HPGD P15428 1/20 0.41
HRH3 Q9Y5N1 9/20 0.41
MKNK1 Q9BUB5 4/20 0.39
MKNK2 Q9HBH9 4/20 0.39
GABRA5 P31644 1/20 0.39

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
SCHEMBL16379914 0.92 PAK4 (0.56) PAK4NAMPTPAK1FASNPRMT3
SCHEMBL18325835 0.91 PAK4 (0.57) PAK4NAMPTPAK1HPGDHRH3
SCHEMBL18325833 0.90 PAK4 (0.54) PAK4NAMPTPAK1HPGDHRH3
SCHEMBL18325828 0.88 PAK4 (0.67) PAK4NAMPTPAK1HRH3GABRA5
SCHEMBL16379913 0.87 PAK4 (0.57) PAK4NAMPTPAK1FASNPRMT3
SCHEMBL18325897 0.86 PAK4 (0.57) PAK4NAMPTPAK1HRH3GABRA5
SCHEMBL18325821 0.84 PAK4 (0.52) PAK4NAMPTPAK1HPGDHRH3
SCHEMBL16379794 0.83 PAK4 (0.59) PAK4NAMPTPAK1HPGDHRH3
SCHEMBL18325826 0.83 PAK4 (0.51) PAK4NAMPTPAK1HPGDHRH3
SCHEMBL18325884 0.83 PAK4 (0.57) PAK4NAMPTPAK1HRH3GABRA5

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-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 (1 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 PAK4 2007/4885NAMPT 1663/4885PAK1 3040/4885

“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.