SCHEMBL1106589

SCHEMBL1106589

[C-]#[N+]c1ccc(-c2nc(CNC(=O)c3ccc(Cl)s3)cs2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.53
RHOC P08134 1/20 0.49
RHOA P61586 1/20 0.49
HPGD P15428 4/20 0.47
TSHR P16473 1/20 0.46
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
ALOX15 P16050 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL10282497 0.83 F10 (0.55) F10RHOCRHOAHPGDTSHR
SCHEMBL1106579 0.83 HPGD (0.47) F10HPGDTSHRLMNATP53
SCHEMBL1097423 0.81 F10 (0.56) F10RHOCRHOAHPGDTSHR
SCHEMBL1096846 0.80 F10 (0.53) F10RHOCRHOAHPGDTSHR
SCHEMBL1097619 0.80 F10 (0.53) F10RHOCRHOAHPGDTSHR
SCHEMBL1106585 0.80 HPGD (0.46) F10HPGDTSHRLMNAKDM4E
SCHEMBL4947618 0.79 F10 (0.52) F10RHOCRHOAHPGDTSHR
SCHEMBL1096804 0.79 F10 (0.52) F10RHOCRHOAHPGDTSHR
SCHEMBL1096188 0.78 F10 (0.53) F10RHOCRHOAHPGDTSHR
SCHEMBL1106607 0.77 F10 (0.46) F10HPGDTSHRLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153670-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-10 US disclosed
US-20090298806-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2009-12-03 US disclosed
US-7521470-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-21 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 (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-20090298806-A1 FACTOR XA INHIBITORS TFPI, F12, F11 F10 8/4885RHOC 3774/4885RHOA 1752/4885

“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.