SCHEMBL21316005

SCHEMBL21316005

N=Cc1cc2cccc(-c3ccc(C(=O)N4CCOCC4)cc3)c2o1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.48
JAK1 P23458 4/20 0.48
TYK2 P29597 3/20 0.48
JAK3 P52333 3/20 0.48
ERN1 O75460 4/20 0.47
RIPK1 Q13546 1/20 0.45
HPGD P15428 4/20 0.45
PHGDH O43175 1/20 0.43
MAPK10 P53779 1/20 0.42
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 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
SCHEMBL16345943 0.80 HRH3 (0.48) JAK2JAK1TYK2JAK3ERN1
SCHEMBL16345139 0.80 PDCD1 (0.49) JAK2JAK1TYK2JAK3ERN1
SCHEMBL28217150 0.77 HPGD (0.50) JAK2JAK1TYK2JAK3ERN1
SCHEMBL12237799 0.72 CHRNA7 (0.62)
Hydrochloric Acid SCHEMBL2198599 0.72 CHRNA7 (0.61)
SCHEMBL13952297 0.70 HPGD (0.60) ERN1RIPK1HPGDPHGDH
SCHEMBL10720943 0.69 PHGDH (0.81) HPGDPHGDH
SCHEMBL28216628 0.69 MKNK1 (0.66) HPGD
SCHEMBL8150805 0.68 HPGD (0.76) HPGDPHGDH
SCHEMBL807334 0.68 KCNH2 (0.54) JAK2JAK1TYK2JAK3RIPK1

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-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2021-12-30 US disclosed
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2021-05-18 US disclosed
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2019-09-03 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 (3 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-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK JAK2 22/4885JAK1 210/4885TYK2 652/4885
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK JAK2 22/4885JAK1 210/4885TYK2 652/4885
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK JAK2 22/4885JAK1 210/4885TYK2 652/4885

“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.