SCHEMBL17788719

SCHEMBL17788719

Cc1cc(C)cc(-c2ncn(C=C(C(=O)OC(C)C)c3ccncc3)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 16/20 0.40
RANBP1 P43487 1/20 0.37
KCNH2 Q12809 1/20 0.37
JMJD6 Q6NYC1 1/20 0.33
ELANE P08246 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL17788720 1.00 XPO1 (0.40) XPO1RANBP1KCNH2JMJD6ELANE
SCHEMBL17788721 1.00 XPO1 (0.40) XPO1RANBP1KCNH2JMJD6ELANE
SCHEMBL19261690 0.91 XPO1 (0.50) XPO1RANBP1KCNH2
SCHEMBL17788862 0.88 TDP1 (0.41) XPO1RANBP1KCNH2ELANEKMT2A
SCHEMBL26326438 0.87 XPO1 (0.51) XPO1RANBP1KCNH2
SCHEMBL17788876 0.87 XPO1 (0.51) XPO1RANBP1KCNH2
SCHEMBL16361561 0.86 XPO1 (0.55) XPO1RANBP1KCNH2
SCHEMBL17790550 0.86 XPO1 (0.55) XPO1RANBP1KCNH2
SCHEMBL17788872 0.84 XPO1 (0.41) XPO1RANBP1KCNH2
SCHEMBL17788864 0.83 XPO1 (0.53) XPO1RANBP1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155317-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2018-06-07 US disclosed
US-9738624-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2017-08-22 US disclosed
US-20160152596-A1 Nuclear Transport Modulators and Uses Thereof Karyopharm Therapeutics Inc. (US) 2016-06-02 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 (2 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-20180155317-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT XPO1 1/4885RANBP1 159/4885KCNH2 4379/4885
US-20160152596-A1 Nuclear Transport Modulators and Uses Thereof XPO5, XPO1, XPOT XPO1 2/4885RANBP1 144/4885KCNH2 4320/4885

“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.