SCHEMBL22095046

SCHEMBL22095046

CS(=O)(=O)c1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AURKA O14965 13/20 0.81
MEN1 O00255 2/20 0.74
KMT2A Q03164 2/20 0.74
MAPT P10636 1/20 0.74
CDK2 P24941 4/20 0.66
TP53 P04637 1/20 0.66
RAB9A P51151 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
KDM5B Q9UGL1 1/20 0.63

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
SCHEMBL22095314 0.94 AURKA (0.76) AURKAMEN1KMT2AMAPTTP53
SCHEMBL22095059 0.92 AURKA (0.67) AURKAMEN1KMT2AMAPTTP53
SCHEMBL22095014 0.92 AURKA (0.80) AURKAMEN1KMT2AMAPTCDK2
SCHEMBL22095290 0.91 MEN1 (0.74) AURKAMEN1KMT2AMAPTCDK2
SCHEMBL22095003 0.89 AURKA (0.67) AURKAMEN1KMT2AMAPTTP53
SCHEMBL22095087 0.89 AURKA (0.84) AURKAMEN1KMT2AMAPTCDK2
SCHEMBL22095268 0.87 AURKA (1.00) AURKAMEN1KMT2AMAPTCDK2
SCHEMBL22095213 0.87 AURKA (0.61) AURKAMEN1KMT2AMAPTTP53
SCHEMBL22095094 0.87 LMNA (0.62) AURKAMEN1KMT2AMAPTTP53
SCHEMBL23928660 0.85 CA12 (0.61) AURKAMEN1KMT2AMAPT

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 3 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
WO-2020123855-A1 INHIBITOR COMPOUNDS FOR MALE CONTRACEPTION UNIVERSITY OF WASHINGTON (US) 2020-06-18 WO 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 AURKA 3852/4885MEN1 3040/4885KMT2A 1384/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 AURKA 3852/4885MEN1 3040/4885KMT2A 1384/4885

“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.