SCHEMBL3076303

SCHEMBL3076303

O=C(NCc1ccn(-c2ccc(I)cc2)c1)c1ccc(Cl)s1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 2/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.41

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
SCHEMBL3089692 0.84 F10 (0.66) F10
SCHEMBL1708736 0.81 HPGD (0.52) F10KDM4ELMNAHPGDTSHR
SCHEMBL3098386 0.80 HPGD (0.46) F10KDM4ELMNAHPGDTSHR
SCHEMBL3087526 0.77 HPGD (0.50) F10KDM4ELMNAHPGDTSHR
SCHEMBL1106557 0.76 MIF (0.61) KDM4ELMNAHPGDTSHR
SCHEMBL1708964 0.75 HPGD (0.48) F10KDM4ELMNAHPGDTSHR
SCHEMBL3087908 0.74 HPGD (0.53) F10KDM4ELMNAHPGDTSHR
SCHEMBL13153502 0.74 F10 (0.53) F10HPGDTSHR
SCHEMBL13153540 0.73 HPGD (0.46) F10KDM4ELMNAHPGDTSHR
SCHEMBL1277419 0.73 HPGD (0.46) F10KDM4EHPGDTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234352-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2010-09-16 US disclosed
US-7696352-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-04-13 US disclosed
EP-2114928-A2 THIOPHENE CARBOXAMIDES AS FACTOR XA INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2009-11-11 EP disclosed
WO-2008086188-A2 THIOPHENE CARBOXAMIDES AS FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-07-17 WO disclosed
US-20070185092-A1 FACTOR Xa INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-08-09 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 (2 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-20070185092-A1 FACTOR Xa INHIBITORS TFPI, F12, F11 F10 10/4885KDM4E 2399/4885LMNA 951/4885
US-20100234352-A1 FACTOR XA INHIBITORS TFPI, F12, F11 F10 10/4885KDM4E 2399/4885LMNA 951/4885

“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.