SCHEMBL25679183

SCHEMBL25679183

NC(=O)c1cc(Cl)c(Br)c(F)c1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.43
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA13 Q8N1Q1 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
CASP1 P29466 2/20 0.36
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
NNMT P40261 1/20 0.34
ALDH1A1 P00352 3/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL20296458 0.85 DGAT1 (0.41) DGAT1CA12CA1CA2CA3
SCHEMBL25679184 0.82 ALDH1A1 (0.44) CA1CA2CASP1KMT2AALDH1A1
SCHEMBL21542694 0.80 DGAT1 (0.40) DGAT1CA12CA1CA2CA3
SCHEMBL21543306 0.80 DGAT1 (0.40) DGAT1CA12CA1CA2CA3
SCHEMBL23540445 0.79 KMT2A (0.45) DGAT1CASP1KMT2AALDH1A1LMNA
SCHEMBL25679223 0.77 DGAT1 (0.43) DGAT1
SCHEMBL14861075 0.77 KMT2A (0.47) DGAT1CASP1KMT2AATMNNMT
SCHEMBL31255703 0.76 ALDH1A1 (0.38) ALDH1A1HPGDSLC9A1
SCHEMBL23496847 0.74 KEAP1 (0.40) CA12CA1CA2CA3CA4
SCHEMBL16636868 0.74 MAPT (0.38) CA12CA1CA2CA3CA4

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-20230203055-A1 FUSED RING COMPOUND AND APPLICATION THEREOF IN MEDICINE BETTA PHARMACEUTICALS CO., LTD (CN) 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-20230203055-A1 FUSED RING COMPOUND AND APPLICATION THEREOF IN MEDICINE VIP, CYP11B2, CYP11B1 DGAT1 3271/4885CA12 1229/4885CA1 3995/4885

“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.