SCHEMBL23928555

SCHEMBL23928555

CS(=O)(=O)c1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)Nc2ccccc2O)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 12/20 0.60
CA9 Q16790 12/20 0.60
CA1 P00915 5/20 0.60
CA2 P00918 5/20 0.60
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
RAB9A P51151 1/20 0.54
LMNA P02545 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 3/20 0.52
KDM4E B2RXH2 2/20 0.52
CDK2 P24941 1/20 0.51

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
SCHEMBL22095639 0.92 LMNA (0.63) CA12CA9CA1CA2MEN1
SCHEMBL23928660 0.91 CA12 (0.61) CA12CA9CA1CA2MEN1
SCHEMBL23928503 0.90 CA12 (0.52) CA12CA9CA1CA2MEN1
SCHEMBL23928510 0.90 CA12 (0.59) CA12CA9CA1CA2MEN1
SCHEMBL23928682 0.88 CA12 (0.57) CA12CA9CA1CA2MEN1
SCHEMBL23928686 0.86 CA12 (0.50) CA12CA9CA1CA2MEN1
SCHEMBL23928596 0.86 CA12 (0.54) CA12CA9CA1CA2MEN1
SCHEMBL22095290 0.85 MEN1 (0.74) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL22095050 0.85 LMNA (0.62) CA12CA9CA1CA2MEN1
SCHEMBL23928477 0.84 LMNA (0.58) CA12CA9MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548875-B2 Inhibitor compounds for male contraception UNIVERSITY OF WASHINGTON (US) 2023-01-10 US disclosed
US-20210332030-A1 INHIBITOR COMPOUNDS FOR MALE CONTRACEPTION UNIVERSITY OF WASHINGTON (US) 2021-10-28 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-20210332030-A1 INHIBITOR COMPOUNDS FOR MALE CONTRACEPTION ALDH1A1, ALDH3A1, ALDH16A1 CA12 4702/4885CA9 4751/4885CA1 3645/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 CA12 4702/4885CA9 4751/4885CA1 3645/4885

“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.