SCHEMBL3963306

SCHEMBL3963306

CCOC(=O)c1cc2ccccc2n1CC(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
NOD2 Q9HC29 2/20 0.57
NOD1 Q9Y239 2/20 0.57
F10 P00742 3/20 0.57
F2 P00734 1/20 0.57
MAPT P10636 1/20 0.55
LMNA P02545 2/20 0.53
KDM4E B2RXH2 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
MPO P05164 1/20 0.48
KDM1A O60341 1/20 0.48
RCOR1 Q9UKL0 1/20 0.48

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
SCHEMBL7431902 0.86 MEN1 (0.57) MEN1KMT2ANOD2NOD1F10
SCHEMBL7424167 0.85 F10 (0.70) MEN1KMT2ANOD2NOD1F10
Iodide SCHEMBL7717783 0.85 F10 (0.68) MEN1KMT2ANOD2NOD1F10
SCHEMBL3963757 0.84 CCR2 (0.64) F10F2POLBMPOKDM1A
SCHEMBL14994342 0.83 MEN1 (0.70) MEN1KMT2ANOD2NOD1F10
SCHEMBL6302610 0.82 NOD2 (0.84) MEN1KMT2ANOD2NOD1F10
SCHEMBL7423741 0.80 KMT2A (0.73) MEN1KMT2ANOD2NOD1F10
SCHEMBL3962292 0.80 NOD2 (0.69) MEN1KMT2ANOD2NOD1F10
SCHEMBL10629278 0.79 KMT2A (0.71) MEN1KMT2ANOD2NOD1F10
SCHEMBL18202169 0.79 MEN1 (0.74) MEN1KMT2ANOD2NOD1F10

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-1451185-B1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2014-08-06 EP disclosed
US-20090069565-A1 NEW INDOLE DERIVATIVES AS FACTOR XA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-12 US disclosed
US-6906084-B2 Indole derivatives as factor Xa inhibitors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-06-14 US disclosed
US-20050043302-A1 New indole derivatives as factor Xa inhibitors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-02-24 US disclosed
EP-1451185-A1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS Aventis Pharma Deutschland GmbH (DE) 2004-09-01 EP disclosed
US-20030199689-A1 New indole derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-10-23 US disclosed
WO-2003044014-A1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-05-30 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 (3 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-20090069565-A1 NEW INDOLE DERIVATIVES AS FACTOR XA INHIBITORS F12, F5, F2 MEN1 802/4885KMT2A 1114/4885NOD2 4235/4885
US-20030199689-A1 New indole derivatives as factor Xa inhibitors F5, F12, F2 MEN1 1167/4885KMT2A 1093/4885NOD2 4293/4885
US-20050043302-A1 New indole derivatives as factor Xa inhibitors F12, F5, F2 MEN1 1026/4885KMT2A 894/4885NOD2 4337/4885

“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.