SCHEMBL3750586

SCHEMBL3750586

Cc1cc(F)ccc1-c1ccccc1CN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.46
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
CSNK2A3 Q8NEV1 1/20 0.43
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
FLT3 P36888 2/20 0.38
MAPK14 Q16539 1/20 0.38
MAPT P10636 2/20 0.37
KCNA5 P22460 1/20 0.37
GPR3 P46089 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
MPO P05164 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
HSD11B1 P28845 1/20 0.36
NMT1 P30419 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
SCHEMBL3786561 0.82 CSNK2A1 (0.57) DPP4CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL3944792 0.82 SYK (0.42) DPP4NOS3NOS1NOS2S1PR1
SCHEMBL27884269 0.79 ESR2 (0.53) DPP4CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL16814936 0.79 DPP4 (0.65) DPP4CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL3756908 0.79 S1PR1 (0.46) FLT3MAPK14MAPTKCNA5GPR3
SCHEMBL2482120 0.79 DPP4 (0.57) DPP4CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL14039912 0.77 PDE3B (0.44) KCNA5GPR3NMT1
SCHEMBL2475943 0.75 MPO (0.44) ALDH1A1MPOLOXL2TAAR1
SCHEMBL17037026 0.75 MAPK14 (0.39) CSNK2A2CSNK2BCSNK2A1CSNK2A3FLT3
SCHEMBL3788233 0.74 DPP4 (0.52) DPP4CSNK2A2CSNK2BCSNK2A1CSNK2A3

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-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias ASTRAZENECA AB (SE) 2010-11-25 US disclosed
US-20080015237-A1 NEW COMPOUNDS I/418 ASTRAZENECA AB (SE) 2008-01-17 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-20080015237-A1 NEW COMPOUNDS I/418 KCNH1, KCNH2, KCNH3 DPP4 4206/4885CSNK2A2 2933/4885CSNK2B 3408/4885
US-20100298392-A1 Isoindoline Derivatives For The Treatment Of Arrhythmias KCNH1, KCNH2, KCNQ2 DPP4 4521/4885CSNK2A2 1783/4885CSNK2B 1836/4885

“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.