SCHEMBL24145486

SCHEMBL24145486

CCCC#CCNC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
PTPN11 Q06124 1/20 0.46
CTSK P43235 8/20 0.45
CTSS P25774 5/20 0.45
TDP1 Q9NUW8 1/20 0.44
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
EPHX1 P07099 1/20 0.37

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
SCHEMBL13306434 0.85 TDP1 (0.53) MEN1GAAKMT2APTPN11CTSK
SCHEMBL14085304 0.84 PTPN11 (0.48) MEN1GAAKMT2APTPN11CTSK
SCHEMBL19787903 0.83 PTPN11 (0.44) MEN1GAAKMT2APTPN11CTSK
SCHEMBL939491 0.81 PTPN11 (0.47) MEN1GAAKMT2APTPN11CTSK
SCHEMBL22770879 0.81 TDP1 (0.46) MEN1GAAKMT2APTPN11CTSK
SCHEMBL659104 0.80 TDP1 (0.52) MEN1GAAKMT2APTPN11CTSK
SCHEMBL13306409 0.80 TDP1 (0.56) MEN1GAAKMT2APTPN11CTSK
SCHEMBL14404775 0.80 CTSK (0.51) MEN1GAAKMT2APTPN11CTSK
SCHEMBL30464727 0.79 CTSK (0.41) MEN1GAAKMT2ACTSKCTSS
SCHEMBL22796979 0.79 MAOA (0.49) MEN1GAAKMT2APTPN11CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2021-12-30 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-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK MEN1 1533/4885GAA 1943/4885KMT2A 160/4885

“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.