SCHEMBL1106560

SCHEMBL1106560

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

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.65
POLB P06746 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
MAPK1 P28482 2/20 0.58
HPGD P15428 4/20 0.55
TSHR P16473 1/20 0.55
DAO P14920 1/20 0.55
GSK3B P49841 1/20 0.50
F2 P00734 1/20 0.50
F10 P00742 2/20 0.49
LMNA P02545 3/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
USP5 P45974 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
SCHEMBL5429273 0.84 F2 (0.58) KMT2APOLBTDP1MAPK1HPGD
SCHEMBL27676813 0.84 MAPK1 (0.60) KMT2APOLBTDP1MAPK1HPGD
SCHEMBL5630030 0.83 MAPK1 (0.63) KMT2AMAPK1HPGDTSHRDAO
SCHEMBL13153491 0.81 MAPK1 (0.57) KMT2APOLBTDP1MAPK1HPGD
SCHEMBL1106565 0.81 MAPK1 (0.57) KMT2APOLBTDP1MAPK1HPGD
SCHEMBL280236 0.80 POLB (0.67) KMT2APOLBTDP1TSHRKDM4E
SCHEMBL14627824 0.80 MAPK1 (0.64) KMT2ATDP1MAPK1HPGDTSHR
SCHEMBL14986443 0.79 GAA (0.67) KMT2APOLBTDP1HPGDDAO
SCHEMBL280023 0.79 POLB (1.00) KMT2APOLBTDP1DAOLMNA
SCHEMBL14986345 0.79 POLB (0.65) KMT2APOLBTDP1TSHRDAO

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-20130137730-A1 INHIBITOR OF CASEIN KINASE 1DELTA AND CASEIN KINASE 1E NB HEALTH LABORATORY CO., LTD. (JP) 2013-05-30 US 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
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 (3 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 KMT2A 3673/4885POLB 3172/4885TDP1 1080/4885
US-20120178733-A1 FACTOR XA INHIBITORS TFPI, F12, F11 KMT2A 3673/4885POLB 3172/4885TDP1 1080/4885
US-20130137730-A1 INHIBITOR OF CASEIN KINASE 1DELTA AND CASEIN KINASE 1E CSNK1A1, CSNK1G1, CSNK1A1L KMT2A 262/4885POLB 1839/4885TDP1 936/4885

“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.