SCHEMBL23928663

SCHEMBL23928663

O=C(O)c1ccc(-n2cc(C(=O)Nc3ccccc3O)c(-c3ccc(O)cc3)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.64
KMT2A Q03164 9/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
MAPT P10636 4/20 0.62
RAB9A P51151 2/20 0.61
POLB P06746 2/20 0.61
ALDH1A1 P00352 1/20 0.61
HTT P42858 1/20 0.61
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
AURKA O14965 5/20 0.55
TP53 P04637 1/20 0.55
KDM5B Q9UGL1 1/20 0.53
RXFP1 Q9HBX9 1/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL23928510 0.88 CA12 (0.59) MEN1KMT2ASMN1; SMN2MAPTRAB9A
SCHEMBL22095639 0.80 LMNA (0.63) MEN1KMT2ASMN1; SMN2MAPTRAB9A
SCHEMBL22095587 0.80 AURKA (0.77) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL23928558 0.80 MEN1 (0.71) MEN1KMT2ASMN1; SMN2MAPTRAB9A
SCHEMBL23928682 0.79 CA12 (0.57) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL23928660 0.78 CA12 (0.61) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL23928555 0.77 CA12 (0.60) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL22095215 0.73 MEN1 (0.69) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL23928595 0.72 MEN1 (0.73) MEN1KMT2ASMN1; SMN2MAPTRAB9A
SCHEMBL23928596 0.72 CA12 (0.54) MEN1KMT2AMAPTPOLBALDH1A1

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 MEN1 3040/4885KMT2A 1384/4885SMN1; SMN2 2873/4885
US-11548875-B2 Inhibitor compounds for male contraception ALDH1A1, ALDH3A1, ALDH16A1 MEN1 3040/4885KMT2A 1384/4885SMN1; SMN2 2873/4885

“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.