SCHEMBL22095640

SCHEMBL22095640

COc1ccccc1NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1OC

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.75
TP53 P04637 3/20 0.58
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
AURKA O14965 8/20 0.55
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.53

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
SCHEMBL22095005 0.92 MAPT (0.71) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL22095227 0.90 MAPT (0.88) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL23928606 0.86 MAPT (0.84) MAPTTP53LMNAGAAAURKA
SCHEMBL22095142 0.86 MAPT (0.84) MAPTTP53LMNAGAAAURKA
SCHEMBL22095578 0.86 MAPT (0.84) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL22095118 0.86 MAPT (1.00) MAPTTP53LMNAGAAAURKA
SCHEMBL22094960 0.83 MAPT (0.76) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL22095074 0.83 MAPT (0.80) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL22095565 0.83 MAPT (0.73) MAPTTP53LMNAGAASMN1; SMN2
SCHEMBL22095615 0.82 MAPT (0.78) MAPTTP53LMNAGAAAURKA

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