SCHEMBL5146569

SCHEMBL5146569

CN1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1.O=S(=O)(Cl)c1ccc(Br)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.64
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
HTT P42858 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
USP2 O75604 1/20 0.58
TSHR P16473 2/20 0.56
LMNA P02545 2/20 0.55
PKM P14618 1/20 0.53
ALDH1A1 P00352 1/20 0.52
APOBEC3A P31941 2/20 0.51
APOBEC3G Q9HC16 2/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL1156725 0.92 ATM (0.69) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL2836256 0.86 KMT2A (0.72) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL31315858 0.83 ALDH1A1 (0.65) HTTPOLBUSP2TSHRLMNA
SCHEMBL9344505 0.83 ALDH1A1 (0.65) HTTPOLBUSP2TSHRLMNA
SCHEMBL8200020 0.76 KMT2A (0.84) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL7564728 0.76 KMT2A (0.84) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL9386579 0.76 KMT2A (0.84) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL7719944 0.76 HTT (0.68) ATMKMT2AMEN1HTTL3MBTL1
SCHEMBL23536066 0.76 USP2 (0.69) KMT2AMEN1HTTL3MBTL1POLB
SCHEMBL2112295 0.76 USP2 (0.76) KMT2AMEN1HTTPOLBSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070287715-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2007-12-13 US disclosed
EP-1778632-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2005123673-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 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-20070287715-A1 Indoles Useful in the Treatment of Inflammation PTGS1, IDO1, PTGES ATM 3830/4885KMT2A 4007/4885MEN1 3621/4885

“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.