SCHEMBL23928571

SCHEMBL23928571

CC(C)(C)OC(=O)Nc1ccc(-c2nn(-c3ccccc3)cc2C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
ATM Q13315 1/20 0.61
AURKA O14965 12/20 0.60
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
RAB9A P51151 2/20 0.58
TP53 P04637 2/20 0.57
MAPT P10636 3/20 0.56
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
POLB P06746 1/20 0.55
HTT P42858 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
SCHEMBL25432836 0.84 CYP17A1 (0.50) AURKAKMT2APOLB
SCHEMBL23928676 0.83 AURKA (0.66) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL4296769 0.81 L3MBTL1 (0.46) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL28771391 0.78 ALDH1A1 (0.78) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL4501557 0.78 ALDH1A1 (0.82) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL6683128 0.77 L3MBTL1 (0.73) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL23928522 0.76 MAPT (0.74) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL6681990 0.76 L3MBTL1 (1.00) L3MBTL1ATMAURKAMEN1KMT2A
SCHEMBL25359886 0.75 CYP17A1 (0.51) KDM4E
SCHEMBL4502915 0.75 ALDH1A1 (0.74) L3MBTL1ATMAURKAMEN1KMT2A

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 L3MBTL1 4048/4885ATM 4205/4885AURKA 3852/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 L3MBTL1 4048/4885ATM 4205/4885AURKA 3852/4885

“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.