SCHEMBL9922247

SCHEMBL9922247

CNc1ccc2c(=O)n(C)cc(CN(C)C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 10/20 0.46
BRD9 Q9H8M2 10/20 0.45
BRD7 Q9NPI1 7/20 0.45
BRD2 P25440 3/20 0.45
TAF1 P21675 2/20 0.39
TGFBR1 P36897 2/20 0.39
ACVR1 Q04771 2/20 0.39
CREBBP Q92793 2/20 0.39
CECR2 Q9BXF3 2/20 0.39
CYP2D6 P10635 2/20 0.39
ACVR2B Q13705 1/20 0.39
BRD8 Q9H0E9 1/20 0.39
SLC18A1 P54219 1/20 0.36
SLC18A2 Q05940 1/20 0.36
RXRA P19793 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
BRPF1 P55201 1/20 0.35
BPTF Q12830 1/20 0.35
TAF1L Q8IZX4 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35

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
SCHEMBL9919108 0.81 BRD9 (0.48) BRD4BRD9BRD7BRD2TAF1
SCHEMBL9922250 0.77 BRD4 (0.54) BRD4BRD9BRD7SLC18A1SLC18A2
SCHEMBL1719807 0.77 BRD4 (0.59) BRD4BRD9BRD7BRD2HTR2A
SCHEMBL9922701 0.75 BRD4 (0.49) BRD4BRD9BRD7SLC18A1SLC18A2
SCHEMBL9922244 0.75 BRD4 (0.51) BRD4BRD9BRD7SLC18A1SLC18A2
SCHEMBL9922251 0.73 KDM4E (0.48) BRD4
SCHEMBL9922249 0.72 BRD4 (0.49) BRD4BRD9BRD7SLC18A1SLC18A2
SCHEMBL9922698 0.71 BRD4 (0.48) BRD4
SCHEMBL12160638 0.71 BRD4 (0.48) BRD4RXRATDP1BRDT
SCHEMBL9922697 0.70 BRD4 (0.48) BRD4

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-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-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 US disclosed
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 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 (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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 BRD4 3071/4885BRD9 1265/4885BRD7 3025/4885
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PIGS, GP6, ASGR1 BRD4 3757/4885BRD9 1068/4885BRD7 3384/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 BRD4 3064/4885BRD9 1264/4885BRD7 2999/4885

“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.