SCHEMBL1336286

SCHEMBL1336286

Cc1cccc(-c2ncn(C=CC(=O)OC(C)C)n2)c1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 19/20 0.64
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL12127019 1.00 XPO1 (0.64) XPO1HDAC1HDAC6
SCHEMBL1336285 1.00 XPO1 (0.64) XPO1HDAC1HDAC6
SCHEMBL16282014 0.88 XPO1 (0.64) XPO1
SCHEMBL26326400 0.88 XPO1 (0.64) XPO1
SCHEMBL1333953 0.88 XPO1 (0.73) XPO1
SCHEMBL1333949 0.88 XPO1 (0.73) XPO1
SCHEMBL1335010 0.88 XPO1 (0.73) XPO1
SCHEMBL20724222 0.85 XPO1 (0.57) XPO1HDAC1HDAC6
SCHEMBL1333731 0.85 XPO1 (0.72) XPO1HDAC1HDAC6
SCHEMBL1333732 0.85 XPO1 (0.72) XPO1HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2014-06-05 US claimed
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2011-11-10 US claimed
EP-2968278-B1 METHODS OF PROMOTING WOUND HEALING USING CRM1 INHIBITORS KARYOPHARM THERAPEUTICS INC (US) 2018-12-12 EP disclosed
US-9550757-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2017-01-24 US disclosed
EP-2542089-B1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2017-01-18 EP disclosed
US-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2014-06-05 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-20140155370-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, NXF1, XPOT XPO1 1/4885HDAC1 434/4885HDAC6 1967/4885
US-20110275607-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, NXF1, XPOT XPO1 1/4885HDAC1 434/4885HDAC6 1967/4885

“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.