SCHEMBL6490396

SCHEMBL6490396

CC(C#N)(c1ccc(Cl)c(C(F)(F)F)c1)c1c(Cl)cc(-n2nc(C(=O)NC(=O)O)c(=O)[nH]c2=O)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
KMT2A Q03164 3/20 0.39
PDE2A O00408 3/20 0.35
THRA P10827 6/20 0.34
RAPGEF3 O95398 2/20 0.34
RAPGEF4 Q8WZA2 2/20 0.34
THRB P10828 6/20 0.33
NOTUM Q6P988 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
MEN1 O00255 2/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5566123 0.91 ATM (0.45) ATMKMT2ATHRARAPGEF3RAPGEF4
SCHEMBL5567323 0.83 THRA (0.47) ATMKMT2ATHRATHRBNOTUM
SCHEMBL10421411 0.82 ATM (0.46) ATMKMT2APDE2ATHRARAPGEF3
SCHEMBL6454982 0.82 THRA (0.42) ATMKMT2ATHRATHRBMEN1
SCHEMBL10419933 0.78 THRA (0.45) ATMKMT2ATHRATHRBMEN1
SCHEMBL5561375 0.78 MEN1 (0.46) KMT2ATHRATHRBMEN1
SCHEMBL10419977 0.75 THRA (0.43) ATMKMT2ATHRATHRBMEN1
SCHEMBL10672779 0.74 THRA (0.44) ATMKMT2ATHRATHRBNOTUM
SCHEMBL10421476 0.71 ATM (0.48) ATMKMT2ATHRAMEN1GAA
SCHEMBL5791574 0.71 THRA (0.52) ATMKMT2ATHRATHRBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951857-B2 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma FREYNE EDDY JEAN EDGARD 2005-10-04 US disclosed
US-6743792-B2 ANTIINFLAMMATORY AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 2004-06-01 US disclosed
US-20030220331-A1 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma FREYNE EDDY JEAN EDGARD (BE) 2003-11-27 US disclosed
US-20020042416-A1 Antiinflammatory agents FREYNE EDDY JEAN EDGARD (BE) 2002-04-11 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-20020042416-A1 Antiinflammatory agents CCR1, CCR6, FPR1 ATM 4851/4885KMT2A 4147/4885PDE2A 956/4885
US-20030220331-A1 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma IL6, CCR1, CCR6 ATM 4769/4885KMT2A 3682/4885PDE2A 1471/4885

“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.