SCHEMBL25720189

SCHEMBL25720189

COc1c(C(=O)Nc2ncccc2OCc2ccccc2)c(=O)n(CC(C)C)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.49
ALOX15 P16050 1/20 0.49
PPIA P62937 10/20 0.48
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 2/20 0.47
HTT P42858 2/20 0.47
USP2 O75604 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL25720195 0.91 HSP90AA1 (0.53) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL24054830 0.90 HSP90AA1 (0.61) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL24054844 0.83 HSP90AA1 (0.65) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL25720097 0.79 KDM4E (0.64) KDM4ESMN1; SMN2ALDH1A1LMNAUSP2
SCHEMBL25720201 0.79 HPGD (0.60) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL25720176 0.78 HSP90AA1 (0.63) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL25720179 0.78 HSP90AA1 (0.77) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL25720792 0.76 HSP90AA1 (0.59) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL24054922 0.75 MEN1 (0.72) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1
SCHEMBL25720819 0.75 KDM4E (0.49) HSP90AA1ALOX15KDM4ESMN1; SMN2ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203003-A1 Notch Inhibitors and Uses Thereof STEMSYNERGY THERAPEUTICS, INC. 2023-06-29 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 (1 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-20230203003-A1 Notch Inhibitors and Uses Thereof NOTCH1, NOTCH2, NOTCH4 HSP90AA1 4749/4885ALOX15 1130/4885PPIA 375/4885

“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.