SCHEMBL4437980

SCHEMBL4437980

N#CCCOCCNC(=O)c1cnn2cc(Cc3ccc(F)c(Cl)c3)cnc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 6/20 0.38
GPR52 Q9Y2T5 1/20 0.38
IRAK4 Q9NWZ3 3/20 0.36
LMNA P02545 2/20 0.36
PDE10A Q9Y233 2/20 0.36
TP53 P04637 1/20 0.35
NTRK1 P04629 3/20 0.35
JAK2 O60674 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KLKB1 P03952 1/20 0.35
HSD11B1 P28845 2/20 0.34

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
SCHEMBL4433594 0.85 PDE2A (0.41) PDE2AIRAK4LMNAPDE10ATP53
SCHEMBL4555621 0.84 GPR52 (0.50) PDE2AGPR52IRAK4LMNAPDE10A
SCHEMBL14033706 0.82 GPR52 (0.41) PDE2AGPR52IRAK4LMNAPDE10A
SCHEMBL4439750 0.80 PDE2A (0.41) PDE2AGPR52IRAK4LMNAPDE10A
SCHEMBL14033317 0.78 PIK3CA (0.40) PDE2AGPR52IRAK4PDE10AALDH1A1
SCHEMBL14033607 0.78 EPHB3 (0.41) PDE2AIRAK4LMNANPC1RAB9A
SCHEMBL14033688 0.76 PDE2A (0.46) PDE2AIRAK4LMNAHPGDALDH1A1
SCHEMBL14033015 0.75 PDE2A (0.41) PDE2AGPR52IRAK4LMNATP53
SCHEMBL4555125 0.74 IRAK4 (0.43) PDE2AIRAK4NTRK1JAK2
SCHEMBL14048912 0.74 PDE2A (0.44) PDE2AIRAK4PDE10AHPGD

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
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP claimed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO claimed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 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-20080255153-A1 New compounds SCD, SCD5, FADS2 PDE2A 2511/4885GPR52 1409/4885IRAK4 1203/4885

“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.