SCHEMBL2705804

SCHEMBL2705804

CCC(C(N)=O)(c1ccccc1)C(F)(F)Cl

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
KCNN4 O15554 7/20 0.41
CYP1A2 P05177 1/20 0.40
HTT P42858 1/20 0.39
KIF11 P52732 1/20 0.38
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.37
CYP2D6 P10635 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
KCNH2 Q12809 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
SCN5A Q14524 3/20 0.37
SCN9A Q15858 3/20 0.37
KDM4E B2RXH2 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36

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
SCHEMBL2699401 0.86 MAPT (0.48) MAPTKMT2AKCNN4HTTKIF11
SCHEMBL2032135 0.75 MAPT (0.52) MAPTKMT2AKCNN4CYP1A2HTT
SCHEMBL3364484 0.75 MAPT (0.52) MAPTKMT2AKCNN4HTTKIF11
SCHEMBL4551817 0.75 CYP1A2 (0.41) MAPTKMT2ACYP1A2KIF11CHRM2
SCHEMBL6017231 0.74 KIF11 (0.45) MAPTKMT2AKCNN4CYP1A2HTT
SCHEMBL19812940 0.74 CYP2C19 (0.44) MAPTKMT2ACYP1A2KIF11CHRM2
SCHEMBL14101182 0.72 MAPT (0.47) MAPTKMT2AKCNN4CYP1A2HTT
SCHEMBL3138017 0.71 MAPT (0.55) MAPTKMT2AKCNN4CYP1A2HTT
SCHEMBL13946506 0.71 MAPT (0.55) MAPTKMT2AKCNN4HTTKIF11
SCHEMBL4030430 0.71 MAPT (0.55) MAPTKMT2AKCNN4HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168668-B2 Compounds ASTRAZENECA AB (SE) 2012-05-01 US disclosed
US-20100286202-A1 New Compounds ASTRAZENECA AB (SE) 2010-11-11 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 (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-20100286202-A1 New Compounds REN, PCSK9, FURIN MAPT 67/4885KMT2A 4014/4885KCNN4 3182/4885

“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.