SCHEMBL19788249

SCHEMBL19788249

NC(=O)C(CCCCNC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)NO

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 16/20 0.67
CA1 P00915 15/20 0.67
CA2 P00918 15/20 0.67
CA12 O43570 7/20 0.67
CA14 Q9ULX7 3/20 0.65
CA7 P43166 2/20 0.65
HTR3A P46098 2/20 0.57
FKBP1A P62942 1/20 0.55

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
SCHEMBL17753778 0.94 CA9 (0.66) CA9CA1CA2CA12CA14
SCHEMBL24519189 0.91 CA9 (0.56) CA9CA1CA2CA12CA14
SCHEMBL24606377 0.89 CA9 (0.69) CA9CA1CA2CA12CA14
SCHEMBL24444501 0.88 CA9 (0.72) CA9CA1CA2CA12CA14
SCHEMBL13915130 0.87 CA9 (0.73) CA9CA1CA2CA12CA14
SCHEMBL12678101 0.86 CA9 (0.72) CA9CA1CA2CA12CA14
SCHEMBL13219607 0.86 CA1 (0.72) CA9CA1CA2CA12CA14
SCHEMBL13815114 0.86 CA1 (0.71) CA9CA1CA2CA12CA14
SCHEMBL19426705 0.85 CA9 (0.71) CA9CA1CA2CA12CA14
SCHEMBL20622624 0.85 CA9 (0.75) CA9CA1CA2CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210015936-A1 METHOD OF PRODUCING AN IMMUNOLIGAND/PAYLOAD CONJUGATE NBE-THERAPEUTICS AG (CH) 2021-01-21 US disclosed
US-10864277-B2 Method of producing an immunoligand/payload conjugate NBE THERAPEUTICS AG (CH) 2020-12-15 US disclosed
US-20190262461-A1 METHOD OF PRODUCING AN IMMUNOLIGAND/PAYLOAD CONJUGATE NBE THERAPEUTICS AG (CH) 2019-08-29 US disclosed
US-9872923-B2 Method of producing an immunoligand/payload conjugate NBE THERAPEUTICS AG (CH) 2018-01-23 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-20190262461-A1 METHOD OF PRODUCING AN IMMUNOLIGAND/PAYLOAD CONJUGATE ENGASE, ENPEP, DNPEP CA9 826/4885CA1 1293/4885CA2 2405/4885
US-10864277-B2 Method of producing an immunoligand/payload conjugate DNPEP, FOLH1, ENGASE CA9 525/4885CA1 873/4885CA2 2403/4885
US-20210015936-A1 METHOD OF PRODUCING AN IMMUNOLIGAND/PAYLOAD CONJUGATE DNPEP, FOLH1, ENGASE CA9 525/4885CA1 873/4885CA2 2403/4885

“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.