SCHEMBL18325916

SCHEMBL18325916

CCc1cc2cc(-c3ccc(C(=O)N4CCC(F)(F)CC4)cc3)cc(-c3ccc(Cl)cc3)c2o1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 2/20 0.53
NAMPT P43490 1/20 0.53
PAK1 Q13153 1/20 0.53
FASN P49327 5/20 0.41
ALDH1A1 P00352 4/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.37
PHGDH O43175 1/20 0.37
HRH3 Q9Y5N1 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LSS P48449 1/20 0.37
SLC6A7 Q99884 1/20 0.36
GPR183 P32249 1/20 0.36

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
SCHEMBL18325901 0.92 PAK4 (0.61) PAK4NAMPTPAK1FASNPOLB
SCHEMBL18325911 0.92 PAK4 (0.54) PAK4NAMPTPAK1ALDH1A1HRH3
SCHEMBL18325914 0.91 PAK4 (0.49) PAK4NAMPTPAK1FASNMAPT
SCHEMBL18325886 0.91 PAK4 (0.51) PAK4NAMPTPAK1FASN
SCHEMBL16379817 0.91 PAK4 (0.55) PAK4NAMPTPAK1FASNALDH1A1
SCHEMBL18325928 0.90 PAK4 (0.47) PAK4NAMPTPAK1FASN
SCHEMBL18325910 0.90 PAK4 (0.48) PAK4NAMPTPAK1FASNALDH1A1
SCHEMBL18325912 0.90 PAK4 (0.52) PAK4NAMPTPAK1FASNHRH3
SCHEMBL18325898 0.90 PAK4 (0.54) PAK4NAMPTPAK1FASNALDH1A1
SCHEMBL18325909 0.89 PAK4 (0.55) PAK4NAMPTPAK1FASNPOLB

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.