SCHEMBL6792483

SCHEMBL6792483

Cc1ccc(-c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.73
MAPT P10636 1/20 0.63
ALDH1A1 P00352 3/20 0.62
HTT P42858 2/20 0.62
POLB P06746 1/20 0.62
IKBKB O14920 1/20 0.59
CHUK O15111 1/20 0.59
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
LMNA P02545 2/20 0.56
EBP Q15125 1/20 0.56
DHCR7 Q9UBM7 1/20 0.56
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL9122576 0.95 MAPT (0.69) PKMMAPTALDH1A1HTTPOLB
SCHEMBL651924 0.95 MAPT (0.69) PKMMAPTALDH1A1HTTPOLB
SCHEMBL5955341 0.95 MAPT (0.69) PKMMAPTALDH1A1HTTPOLB
SCHEMBL8631891 0.93 MAPT (0.67) PKMMAPTALDH1A1HTTPOLB
SCHEMBL8134887 0.93 MAPT (0.67) PKMMAPTALDH1A1HTTPOLB
SCHEMBL6013980 0.93 PKM (0.71) PKMMAPTALDH1A1HTTPOLB
SCHEMBL3419433 0.93 MAPT (0.67) PKMMAPTALDH1A1HTTPOLB
Hydrochloric Acid SCHEMBL3244036 0.93 ALDH1A1 (0.67) PKMMAPTALDH1A1HTTPOLB
SCHEMBL3977980 0.93 PKM (0.71) PKMMAPTALDH1A1HTTPOLB
Bromide SCHEMBL3967182 0.92 MAPT (0.65) PKMMAPTALDH1A1HTTPOLB

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 PKM 4658/4885MAPT 4881/4885ALDH1A1 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.