SCHEMBL1106565

SCHEMBL1106565

COC(=O)CNC(=O)c1ccc(Cl)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.57
HPGD P15428 2/20 0.51
TSHR P16473 2/20 0.51
KMT2A Q03164 5/20 0.48
KDM4E B2RXH2 3/20 0.48
POLB P06746 2/20 0.48
MEN1 O00255 2/20 0.48
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GSK3B P49841 1/20 0.46
F10 P00742 1/20 0.46
F2 P00734 1/20 0.46
DAO P14920 1/20 0.46
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45

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
SCHEMBL27676813 0.83 MAPK1 (0.60) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL8791087 0.82 POLB (0.71) KMT2APOLBTDP1LMNANPC1
SCHEMBL6169349 0.82 MAPK1 (0.59) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL1106560 0.81 KMT2A (0.65) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL13153491 0.81 MAPK1 (0.57) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL8791444 0.81 NPSR1 (0.61) HPGDTSHRKMT2AKDM4EPOLB
SCHEMBL5429273 0.80 F2 (0.58) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL14627824 0.80 MAPK1 (0.64) MAPK1HPGDTSHRKMT2AKDM4E
SCHEMBL8790454 0.79 SMN1; SMN2 (0.56) HPGDTSHRKMT2AKDM4EPOLB
SCHEMBL13402900 0.78 POLB (0.45) MAPK1TSHRKMT2AKDM4EPOLB

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
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-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-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-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 MAPK1 2929/4885HPGD 316/4885TSHR 2852/4885
US-20120178733-A1 FACTOR XA INHIBITORS TFPI, F12, F11 MAPK1 2929/4885HPGD 316/4885TSHR 2852/4885

“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.