SCHEMBL3369801

SCHEMBL3369801

Nc1ccc(S(=O)(=O)CCO)cc1N

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.60
PKM P14618 2/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 5/20 0.48
HTR6 P50406 1/20 0.48
POLB P06746 1/20 0.46
LOX P28300 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
HSD17B10 Q99714 1/20 0.40
HTT P42858 1/20 0.38

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
SCHEMBL9558916 0.85 CA2 (0.61) CA2PKMGAAMAPTKDM4E
SCHEMBL5677264 0.85 CA2 (0.61) CA2PKMGAAMAPTKDM4E
SCHEMBL10606415 0.85 CA2 (0.81) CA2PKMGAAMAPTKDM4E
SCHEMBL5674072 0.85 CA2 (0.59) CA2PKMGAAMAPTKDM4E
SCHEMBL9335332 0.84 CA2 (0.50) CA2PKMMAPTKDM4EMEN1
SCHEMBL9498638 0.84 CA2 (0.58) CA2MEN1KMT2AALDH1A1POLB
SCHEMBL9404072 0.84 CA2 (0.55) CA2GAAMAPTMEN1KMT2A
SCHEMBL9149714 0.84 CA2 (0.59) CA2PKMGAAMAPTKDM4E
SCHEMBL130972 0.84 CA2 (0.53) CA2ALDH1A1POLBLOXCA12
SCHEMBL7753243 0.84 CA2 (0.55) CA2GAAMAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636216-B1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-21 EP disclosed
US-7741341-B2 Benzimidazole-derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-06-22 US disclosed
EP-1636216-A1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-03-22 EP disclosed
US-20050009829-A1 Benzimidazole-derivatives as factor Xa inhibitors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-13 US disclosed
WO-2004101553-A1 BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-11-25 WO disclosed
EP-1479676-A1 Benzimidazole-derivatives as factor xa inhibitors Aventis Pharma Deutschland GmbH (DE) 2004-11-24 EP disclosed
US-4948919-A DYE INTERMEDIATES HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-14 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-20050009829-A1 Benzimidazole-derivatives as factor Xa inhibitors F12, F11, F5 CA2 3109/4885PKM 127/4885GAA 41/4885

“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.