SCHEMBL841667

SCHEMBL841667

O=S(=O)(c1ccc(Br)cc1Br)N1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
TSHR P16473 3/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 2/20 0.50
EPHX2 P34913 1/20 0.50
KDM4E B2RXH2 1/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KMT2A Q03164 2/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
NPC1 O15118 1/20 0.46

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
SCHEMBL2935769 0.84 TSHR (0.50) LMNATSHRHTTALDH1A1POLB
SCHEMBL2927007 0.84 ALDH1A1 (0.66) LMNATSHRHTTALDH1A1KDM4E
SCHEMBL23294420 0.83 KMT2A (0.60) LMNATSHRHTTALDH1A1KDM4E
SCHEMBL12655659 0.82 TSHR (0.53) LMNATSHRHTTEPHX2POLB
SCHEMBL16345591 0.81 LMNA (0.54) LMNATSHRHTTALDH1A1KDM4E
SCHEMBL24512262 0.81 LMNA (0.65) LMNAHTTALDH1A1MAPTKMT2A
SCHEMBL29717131 0.81 LMNA (0.65) LMNAHTTALDH1A1MAPTKMT2A
SCHEMBL840799 0.81 CNR2 (0.57) LMNATSHRHTTALDH1A1POLB
SCHEMBL20627051 0.80 POLB (0.53) LMNATSHRALDH1A1EPHX2POLB
SCHEMBL841693 0.80 CNR2 (0.55) LMNATSHRALDH1A1POLBMAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176223-B1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI SA (FR) 2013-01-23 EP disclosed
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
EP-2176223-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY Sanofi-Aventis (FR) 2010-04-21 EP disclosed
WO-2009007015-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2009-01-15 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-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY F7, F9, TFPI LMNA 546/4885TSHR 3157/4885HTT 4477/4885

“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.