SCHEMBL22095074

SCHEMBL22095074

COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccccc2OC)c1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.80
LMNA P02545 3/20 0.70
TP53 P04637 2/20 0.69
KMT2A Q03164 4/20 0.68
MEN1 O00255 2/20 0.68
USP2 O75604 1/20 0.68
ALDH1A1 P00352 1/20 0.68
HPGD P15428 1/20 0.68
HTT P42858 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
TAAR1 Q96RJ0 1/20 0.68
HSD17B10 Q99714 1/20 0.68
AURKA O14965 6/20 0.63
GAA P10253 1/20 0.61
NPSR1 Q6W5P4 1/20 0.59

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
SCHEMBL22095227 0.91 MAPT (0.88) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095565 0.90 MAPT (0.73) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095118 0.89 MAPT (1.00) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095301 0.87 MAPT (0.68) MAPTLMNATP53KMT2AMEN1
SCHEMBL22094960 0.86 MAPT (0.76) MAPTLMNATP53KMT2AMEN1
SCHEMBL23928606 0.85 MAPT (0.84) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095142 0.85 MAPT (0.84) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095578 0.85 MAPT (0.84) MAPTLMNATP53KMT2AMEN1
SCHEMBL22095640 0.83 MAPT (0.75) MAPTLMNATP53KMT2AMEN1
SCHEMBL4771997 0.83 LMNA (1.00) MAPTLMNATP53KMT2AMEN1

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 MAPT 4083/4885LMNA 1751/4885TP53 4039/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 MAPT 4083/4885LMNA 1751/4885TP53 4039/4885

“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.