SCHEMBL1096152

SCHEMBL1096152

CN(C)Cc1cccc(-c2ccc(-c3cc(CNC(=O)c4ccc(Cl)s4)on3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
HPGD P15428 4/20 0.45
LMNA P02545 3/20 0.44
F10 P00742 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HTT P42858 2/20 0.43
JAK2 O60674 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.42
CYP1A2 P05177 1/20 0.40
ROCK2 O75116 1/20 0.40
PRKCA P17252 1/20 0.40
GRK2 P25098 1/20 0.40
KDM4E B2RXH2 1/20 0.39
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
PIK3CD O00329 1/20 0.37
AOC3 Q16853 1/20 0.37

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
SCHEMBL1095812 0.95 F10 (0.45) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096578 0.93 POLB (0.44) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096500 0.92 POLB (0.50) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096354 0.84 LMNA (0.46) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1095698 0.84 HPGD (0.53) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096625 0.83 F10 (0.45) POLBLMNAF10SMN1; SMN2ALDH1A1
SCHEMBL1095906 0.82 HPGD (0.41) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1101073 0.82 POLB (0.56) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096444 0.81 POLB (0.65) POLBHPGDLMNAF10SMN1; SMN2
SCHEMBL1096092 0.81 HPGD (0.47) POLBHPGDLMNAF10SMN1; SMN2

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 12 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 claimed
EP-1893572-B1 FACTOR XA INHIBITORS MILLENNIUM PHARM INC (US) 2016-12-14 EP disclosed
US-8377974-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-02-19 US disclosed
US-20120178733-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2012-07-12 US disclosed
US-8153670-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-10 US disclosed
US-8153670-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-10 US disclosed
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-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
US-7521470-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
WO-2006002099-A2 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-01-05 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 (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-20090298806-A1 FACTOR XA INHIBITORS TFPI, F12, F11 POLB 3172/4885HPGD 316/4885LMNA 734/4885
US-20120178733-A1 FACTOR XA INHIBITORS TFPI, F12, F11 POLB 3172/4885HPGD 316/4885LMNA 734/4885

“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.