SCHEMBL23928583

SCHEMBL23928583

CS(=O)(=O)c1ccc(-c2nn(-c3cccc(F)c3)cc2C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 1/20 0.52
NR1H4 Q96RI1 1/20 0.52
AURKA O14965 9/20 0.50
CA12 O43570 3/20 0.48
CA9 Q16790 3/20 0.48
TP53 P04637 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CDK2 P24941 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL23928567 0.92 NR1H4 (0.55) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928563 0.89 MEN1 (0.60) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928632 0.89 AURKA (0.54) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928562 0.88 MEN1 (0.55) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928508 0.87 MEN1 (0.52) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928692 0.85 LMNA (0.48) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928696 0.85 MEN1 (0.57) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL22095289 0.84 MEN1 (0.67) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL23928638 0.84 MEN1 (0.59) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL22095635 0.84 MAPT (0.61) MAPTKDM4ELMNAMEN1KMT2A

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 MAPT 4083/4885KDM4E 1675/4885LMNA 1751/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 MAPT 4083/4885KDM4E 1675/4885LMNA 1751/4885

“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.