SCHEMBL23928510

SCHEMBL23928510

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

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.59
CA9 Q16790 9/20 0.59
MEN1 O00255 7/20 0.58
KMT2A Q03164 7/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
RAB9A P51151 2/20 0.58
MAPT P10636 3/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
HTT P42858 1/20 0.56
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
KDM5B Q9UGL1 1/20 0.50

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 0.93 LMNA (0.63) CA12CA9MEN1KMT2ASMN1; SMN2
SCHEMBL23928682 0.91 CA12 (0.57) CA12CA9MEN1KMT2AMAPT
SCHEMBL23928660 0.90 CA12 (0.61) CA12CA9MEN1KMT2AMAPT
SCHEMBL23928555 0.90 CA12 (0.60) CA12CA9MEN1KMT2ARAB9A
SCHEMBL23928663 0.88 MEN1 (0.64) MEN1KMT2ASMN1; SMN2RAB9AMAPT
SCHEMBL23928596 0.85 CA12 (0.54) CA12CA9MEN1KMT2AMAPT
SCHEMBL23928503 0.83 CA12 (0.52) CA12CA9MEN1KMT2ARAB9A
SCHEMBL22094946 0.83 LMNA (0.80) CA12CA9MEN1KMT2ASMN1; SMN2
SCHEMBL22095050 0.82 LMNA (0.62) CA12CA9MEN1KMT2ARAB9A
SCHEMBL22095094 0.82 LMNA (0.62) CA12CA9MEN1KMT2AMAPT

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 4751/4885MEN1 3040/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 CA12 4702/4885CA9 4751/4885MEN1 3040/4885

“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.