SCHEMBL6009923

SCHEMBL6009923

O=S(=O)(O)CCCNCc1ccc(Br)cc1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 5/20 0.41
FPR2 P25090 5/20 0.41
USP28 Q96RU2 1/20 0.41
P2RX7 Q99572 1/20 0.40
ACHE P22303 4/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
AKR1B1 P15121 2/20 0.38
KDM1A O60341 1/20 0.38
GRK2 P25098 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL5504100 0.89 CA12 (0.41) USP28ACHECA12CA1CA2
SCHEMBL5504112 0.80 MPO (0.57) ACHECA12CA1CA2CA9
SCHEMBL11703167 0.74 AKR1B1 (0.51) P2RX7AKR1B1GRK2RECQLSMN1; SMN2
SCHEMBL19416985 0.74 USP28 (0.46) FPR3FPR2USP28P2RX7AKR1B1
SCHEMBL5506450 0.72 CHRM2 (0.42) ACHE
SCHEMBL18731471 0.71 FPR3 (0.53) FPR3FPR2ACHEKDM1ASMN1; SMN2
SCHEMBL13172655 0.70 P2RX7 (0.45) P2RX7CA2AKR1B1KDM1A
SCHEMBL6009935 0.70 CHRM2 (0.66) ACHECA12CA1CA2L3MBTL1
SCHEMBL5504080 0.69 HDAC3 (0.50)
SCHEMBL5510239 0.69 CNR2 (0.45) SMN1; SMN2

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-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2006-08-17 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-20060183800-A1 Methods and fluorinated compositions for treating amyloid-related diseases APP, PSEN1, TTR FPR3 45/4885FPR2 80/4885USP28 2528/4885

“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.