SCHEMBL31460065

SCHEMBL31460065

COC(=O)c1cc(Br)c(OC)cc1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.48
KDM4E B2RXH2 9/20 0.47
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
HSD17B10 Q99714 4/20 0.44
GAA P10253 4/20 0.44
MAPK1 P28482 2/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 3/20 0.44
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 1/20 0.41
HTT P42858 1/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 3/20 0.40
CFTR P13569 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40

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
SCHEMBL25259828 0.95 KDM4E (0.50) SOS1KDM4ELCKFYNHSD17B10
SCHEMBL23364330 0.87 KDM4E (0.61) KDM4ELCKFYNHSD17B10GAA
SCHEMBL30447954 0.87 KDM4E (0.56) SOS1KDM4ELCKFYNHSD17B10
SCHEMBL25341632 0.87 KDM4E (0.56) SOS1KDM4ELCKFYNHSD17B10
SCHEMBL8380009 0.85 SOS1 (0.50) SOS1KDM4ELCKFYNHSD17B10
SCHEMBL383036 0.85 GAA (0.53) SOS1KDM4ELCKFYNHSD17B10
SCHEMBL30949581 0.84 LCK (0.59) KDM4ELCKFYNHSD17B10MAPT
SCHEMBL10692871 0.82 HTT (0.50) KDM4ELCKFYNHSD17B10GAA
SCHEMBL31587771 0.82 HTT (0.50) KDM4ELCKFYNHSD17B10GAA
SCHEMBL18920679 0.82 KDM4E (0.47) SOS1KDM4ELCKFYNHSD17B10

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-20250154163-A1 Pyrimidinone-Containing 17-Beta-Hydroxysteroid Dehydrogenase Type 13 Inhibitors ENANTA PHARMACEUTICALS, INC. 2025-05-15 US disclosed
WO-2025090868-A1 PYRIMIDINONE-CONTAINING 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2025-05-01 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 (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-20250154163-A1 Pyrimidinone-Containing 17-Beta-Hydroxysteroid Dehydrogenase Type 13 Inhibitors HSD17B13, HSD17B1, HSD11B1 SOS1 2794/4885KDM4E 2297/4885LCK 4517/4885

“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.