SCHEMBL9922200

SCHEMBL9922200

O=C(Nc1ccc(-n2ccc3cc4ncsc4cc3c2=O)c(F)c1)NS(=O)(=O)c1cccs1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.37
MEN1 O00255 9/20 0.37
LMNA P02545 4/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 5/20 0.35
MAPK1 P28482 3/20 0.33
HTT P42858 2/20 0.33
POLB P06746 2/20 0.33
HPGD P15428 2/20 0.33
GOT1 P17174 1/20 0.33
TSHR P16473 1/20 0.33
CHRM5 P08912 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
AURKA O14965 1/20 0.32
RECQL P46063 1/20 0.32
HIF1A Q16665 1/20 0.32
JAK3 P52333 1/20 0.32

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
SCHEMBL13182774 0.88 P2RY12 (0.36) KMT2AMEN1ALDH1A1MAPTMAPK1
SCHEMBL9922809 0.88 P2RY12 (0.44) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL9922212 0.86 KMT2A (0.36) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL9922201 0.85 KMT2A (0.38) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL9922206 0.82 KMT2A (0.39) KMT2AMEN1LMNAALDH1A1MAPT
SCHEMBL12161005 0.80 CHRM5 (0.46) MAPTCHRM5P2RY12
SCHEMBL12177267 0.79 CHRM5 (0.38) CHRM5P2RY12
SCHEMBL9922620 0.79 CHRM5 (0.33) ALDH1A1MAPTMAPK1GOT1CHRM5
SCHEMBL9922862 0.77 CHRM5 (0.34) CHRM5NPC1RAB9AP2RY12
SCHEMBL9922268 0.75 P2RY12 (0.45) KMT2AMEN1LMNAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524721-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 KMT2A 3009/4885MEN1 4498/4885LMNA 3576/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 KMT2A 3023/4885MEN1 4499/4885LMNA 3603/4885

“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.