SCHEMBL713901

SCHEMBL713901

CC(NC(=O)O)c1cc2cccc(Cl)c2nc1N1CCS(=O)(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 5/20 0.43
AKT2 P31751 5/20 0.43
AKT3 Q9Y243 5/20 0.43
CNR2 P34972 3/20 0.36
CNR1 P21554 1/20 0.36
P2RY12 Q9H244 1/20 0.35
PIK3CA P42336 1/20 0.35
TNF P01375 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
MAPK14 Q16539 1/20 0.33
GPR139 Q6DWJ6 1/20 0.33
SOS1 Q07889 1/20 0.33
FAAH O00519 1/20 0.32
FABP3 P05413 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
FABP4 P15090 1/20 0.32
FABP5 Q01469 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
SCHEMBL716164 0.89 AKT1 (0.40) AKT1AKT2AKT3CNR2L3MBTL1
SCHEMBL717045 0.87 PIK3CB (0.40) PIK3CACYP3A4CYP2C9KDM4EALDH1A1
SCHEMBL715607 0.86 CNR2 (0.43) CNR2CNR1P2RY12KDM4EALDH1A1
SCHEMBL716476 0.84 CNR1 (0.40) CNR2CNR1TDP1CYP2C9KDM4E
SCHEMBL716682 0.83 MAPT (0.48) CNR2CNR1P2RY12SOS1KDM4E
SCHEMBL715574 0.82 STK4 (0.41) CNR2CNR1USP2ALDH1A1TSHR
SCHEMBL715103 0.82 KDM4E (0.39) CNR2KDM4EALDH1A1
SCHEMBL715104 0.82 KDM4E (0.39) CNR2KDM4EALDH1A1
SCHEMBL715705 0.82 KDM4E (0.39) CNR2KDM4EALDH1A1
SCHEMBL17530837 0.82 ADRA2A (0.34) AKT1AKT2AKT3P2RY12PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP disclosed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US disclosed
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2012-03-01 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 (1 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-20120053167-A1 Triazine Derivatives as Kinase Inhibitors MAP3K15, PI4KA, MAP3K20 AKT1 297/4885AKT2 278/4885AKT3 277/4885

“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.