SCHEMBL18325928

SCHEMBL18325928

CCc1cc2cc(-c3ccc(C(=O)N4CCC(F)(F)CC4)cc3F)cc(-c3ccc(Cl)cc3)c2o1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 2/20 0.47
NAMPT P43490 1/20 0.47
PAK1 Q13153 1/20 0.47
FASN P49327 3/20 0.46
HTR1A P08908 7/20 0.37
MGLL Q99685 1/20 0.37
MCHR1 Q99705 1/20 0.37
ADRA1A P35348 1/20 0.36
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 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
SCHEMBL18325934 0.93 PAK4 (0.44) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL18325929 0.93 PAK4 (0.53) PAK4NAMPTPAK1FASNMGLL
SCHEMBL18325925 0.92 PAK4 (0.47) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL16379820 0.92 PAK4 (0.48) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL18325933 0.91 PAK4 (0.42) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL18325916 0.90 PAK4 (0.53) PAK4NAMPTPAK1FASN
SCHEMBL18325926 0.90 PAK4 (0.41) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL18325910 0.88 PAK4 (0.48) PAK4NAMPTPAK1FASNHTR1A
SCHEMBL18325930 0.88 PAK4 (0.46) PAK4NAMPTPAK1FASNMGLL
SCHEMBL18325932 0.87 PAK4 (0.45) PAK4NAMPTPAK1HTR1AHPGD

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.