SCHEMBL6794953

SCHEMBL6794953

O=C(C1CCN(c2ncncn2)CC1)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.78
USP2 O75604 1/20 0.78
TSHR P16473 1/20 0.78
MAPK1 P28482 1/20 0.78
HSD17B10 Q99714 1/20 0.78
F10 P00742 1/20 0.60
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
KMT2A Q03164 2/20 0.57
ATM Q13315 1/20 0.55
LSS P48449 3/20 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
SCHEMBL1387275 0.87 LSS (0.73) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL1387210 0.85 F10 (0.82) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL4270641 0.82 CNR1 (0.69) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL6798769 0.82 F10 (0.76) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL1387222 0.81 TSHR (0.76) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL6177993 0.81 LMNA (0.67) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL27486943 0.80 HSD17B10 (0.51) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL1387187 0.78 F10 (0.77) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL6181418 0.78 LMNA (0.61) LMNAUSP2TSHRMAPK1HSD17B10
SCHEMBL6792893 0.78 F10 (0.74) LMNAUSP2TSHRMAPK1HSD17B10

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 claimed
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
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 LMNA 412/4885USP2 3876/4885TSHR 333/4885

“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.