SCHEMBL6798671

SCHEMBL6798671

O=C(CCCNS(=O)(=O)c1ccc2ccccc2c1)N1CCN(c2ccncc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.59
F10 P00742 2/20 0.57
ALDH1A1 P00352 2/20 0.56
P2RX7 Q99572 1/20 0.54
GFER P55789 1/20 0.52
CHRM1 P11229 3/20 0.52
HTR6 P50406 2/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 2/20 0.52
MAPK1 P28482 1/20 0.52
HTR1A P08908 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL6786575 0.91 F10 (0.52) HTR7F10ALDH1A1P2RX7GFER
SCHEMBL6786506 0.88 F10 (0.60) HTR7F10ALDH1A1P2RX7LMNA
SCHEMBL6791400 0.82 HTR7 (0.62) HTR7F10ALDH1A1HTR6HTR1A
SCHEMBL6791893 0.80 PKM (0.55) HTR7F10HTR6LMNAHTR1A
SCHEMBL7123827 0.79 F10 (0.49) F10ALDH1A1P2RX7LMNA
SCHEMBL6786184 0.77 F10 (0.49) HTR7F10ALDH1A1LMNA
SCHEMBL6792061 0.76 F10 (0.53) F10ALDH1A1
SCHEMBL6789035 0.75 ATM (0.64) F10ALDH1A1CHRM1LMNAMAPT
SCHEMBL7013843 0.74 F10 (0.87) F10
SCHEMBL5489738 0.74 ATM (0.71) F10ALDH1A1CHRM1LMNAMAPK1

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
US-6730672-B2 PROTEASE INHIBITOR ZENECA LIMITED (GB) 2004-05-04 US disclosed
US-20020119968-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2002-08-29 US disclosed
US-6225309-B1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED (GB) 2001-05-01 US disclosed
US-5965559-A STRONG INHIBITORY EFFECT AGAINST THE ACTIVATED COAGULATION PROTEASE KNOWN AS FACTOR XA; PREVENTION OF THE CLEAVAGE OF PROTHROMBIN TO THROMBIN; AMINO-SUBSTITUTED PYRIMIDINES AMIDINE GROUP-FREE ZENECA LIMITED (GB) 1999-10-12 US disclosed
EP-0783500-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LTD (GB) 1998-07-22 EP disclosed
EP-0783500-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1997-07-16 EP disclosed
WO-1996010022-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1996-04-04 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-20020119968-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents SERPINC1, F2, SULT1E1 HTR7 3379/4885F10 35/4885ALDH1A1 1423/4885

“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.