SCHEMBL19683379

SCHEMBL19683379

CC(=O)Oc1cc2cc(Br)c(OC(C)=O)cc2cc1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 1/20 0.51
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
CFD P00746 2/20 0.44
TNFSF11 O14788 1/20 0.42
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
TSHR P16473 3/20 0.41
GAA P10253 2/20 0.41
RAB9A P51151 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
KMT2A Q03164 2/20 0.40
BLM P54132 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL20208856 1.00 NCEH1 (0.51) NCEH1CA12CA9CFDTNFSF11
SCHEMBL14232433 0.89 NCEH1 (0.64) NCEH1CA12CA9CFDKDM4E
SCHEMBL14597441 0.89 CFD (0.48) NCEH1CA12CA9CFDTNFSF11
SCHEMBL6934323 0.88 KDM4E (0.50) NCEH1CA12CA9KDM4EALDH1A1
SCHEMBL3326702 0.79 TNFSF11 (0.63) TNFSF11ALDH1A1TSHRHPGDPTGS1
SCHEMBL16393718 0.79 CFD (0.42) NCEH1CFDTNFSF11KDM4EALDH1A1
SCHEMBL24165413 0.78 CFD (0.44) NCEH1CFDTNFSF11KDM4EALDH1A1
SCHEMBL8898882 0.78 CFD (0.58) CFDTNFSF11KDM4EALDH1A1TSHR
SCHEMBL30648030 0.78 CFD (0.44) NCEH1CFDTNFSF11KDM4EALDH1A1
SCHEMBL11041225 0.76 ACHE (0.41) NCEH1CFDTNFSF11KDM4EALDH1A1

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-20250304595-A1 Electroactive Compounds LG CHEM, LTD. (KR) 2025-10-02 US disclosed
US-12384796-B2 Electroactive compounds LG CHEM, LTD. (KR) 2025-08-12 US disclosed
WO-2017210072-A1 ELECTROACTIVE COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2017-12-07 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-20250304595-A1 Electroactive Compounds NAT1, NES, SULT1E1 NCEH1 785/4885CA12 2587/4885CA9 3014/4885
US-12384796-B2 Electroactive compounds NES, NAT1, SCN1B NCEH1 885/4885CA12 2583/4885CA9 3026/4885

“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.