SCHEMBL841819

SCHEMBL841819

CC(N)c1cccc(S(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.40
CA2 P00918 4/20 0.40
RXFP1 Q9HBX9 3/20 0.39
ESPL1 Q14674 1/20 0.39
HTR2A P28223 1/20 0.39
TSPO P30536 1/20 0.39
GPR183 P32249 1/20 0.39
APLNR P35414 1/20 0.39
EPAS1 Q99814 2/20 0.38
HRH4 Q9H3N8 1/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR1 P21554 1/20 0.36
P2RX1 P51575 1/20 0.36

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
SCHEMBL10176301 0.86 CA2 (0.44) ALDH1A1LMNACA2RXFP1ESPL1
SCHEMBL10179646 0.82 HDAC4 (0.51) ALDH1A1LMNACA2RXFP1ESPL1
SCHEMBL25643650 0.80 SMN1; SMN2 (0.42) ALDH1A1LMNACA2RXFP1ESPL1
SCHEMBL3465330 0.79 ALDH1A1 (0.45) ALDH1A1CA2
SCHEMBL8249478 0.79 CA2 (0.59) CA2
SCHEMBL30358121 0.79 ALDH1A1 (0.45) ALDH1A1CA2
SCHEMBL4631093 0.79 CA2 (0.59) CA2
SCHEMBL17061124 0.79 ALDH1A1 (0.45) ALDH1A1CA2
SCHEMBL30117178 0.79 ALDH1A1 (0.45) ALDH1A1CA2
SCHEMBL26101860 0.79 ALDH1A1 (0.45) ALDH1A1CA2

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
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-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
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 ALDH1A1 293/4885LMNA 546/4885CA2 1258/4885

“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.