SCHEMBL8996768

SCHEMBL8996768

CS(=O)(=O)Nc1ccc2nc(Br)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.47
BRPF1 P55201 1/20 0.47
KCNH2 Q12809 1/20 0.42
NR3C2 P08235 1/20 0.41
TP53 P04637 1/20 0.41
MAPK10 P53779 1/20 0.40
KDM1A O60341 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL9676236 0.82 NPC1 (0.51) METBRPF1KCNH2NR3C2KDM1A
SCHEMBL17442627 0.78 NPBWR1 (0.41) ALDH1A1HPGDSMN1; SMN2
SCHEMBL26352480 0.78 RAB9A (0.53) METBRPF1KCNH2NR3C2TP53
SCHEMBL8569802 0.77 MET (0.45) METBRPF1KCNH2NR3C2TP53
SCHEMBL17375009 0.76 BRPF1 (0.46) METBRPF1KCNH2MAPK10CA1
SCHEMBL695033 0.76 BRPF1 (0.51) BRPF1NR3C2CA1CA2ALDH1A1
SCHEMBL26613503 0.76 LMNA (0.58) METKCNH2NR3C2TP53KDM1A
SCHEMBL171701 0.75 CA1 (0.67) BRPF1NR3C2CA1CA2ALDH1A1
SCHEMBL30186176 0.75 CA1 (0.67) BRPF1NR3C2CA1CA2ALDH1A1
SCHEMBL29625693 0.75 CA1 (0.67) BRPF1NR3C2CA1CA2ALDH1A1

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-8188104-B2 Anti-infective agents and uses thereof ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-20090186912-A1 ANTI-INFECTIVE AGENTS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-07-23 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-20090186912-A1 ANTI-INFECTIVE AGENTS AND USES THEREOF MPO, SERPINB1, ELANE MET 4151/4885BRPF1 2988/4885KCNH2 3916/4885

“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.