SCHEMBL14033015

SCHEMBL14033015

O=C(NCc1cccc(CO)n1)c1cnn2cc(Cc3ccc(F)c(Cl)c3)cnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.41
GPR52 Q9Y2T5 1/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 2/20 0.40
PKM P14618 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NTRK1 P04629 2/20 0.40
JAK2 O60674 1/20 0.40
IRAK4 Q9NWZ3 3/20 0.39
STING1 Q86WV6 1/20 0.39
MAPK1 P28482 1/20 0.38
MET P08581 1/20 0.38
ADORA2A P29274 2/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A1 P04798 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL4555621 0.84 GPR52 (0.50) PDE2AGPR52NTRK1JAK2IRAK4
SCHEMBL4439750 0.81 PDE2A (0.41) PDE2AGPR52KDM4EPKMHSD17B10
SCHEMBL14033706 0.80 GPR52 (0.41) PDE2AGPR52TP53KDM4EPKM
SCHEMBL14033317 0.79 PIK3CA (0.40) PDE2AGPR52KDM4EIRAK4MAPK1
SCHEMBL4437980 0.75 PDE2A (0.38) PDE2AGPR52TP53NTRK1JAK2
SCHEMBL4555125 0.74 IRAK4 (0.43) PDE2AKDM4EPKMHSD17B10NTRK1
SCHEMBL14033169 0.72 PDE2A (0.42) PDE2AKDM4EPKMHSD17B10IRAK4
SCHEMBL14033166 0.72 PDE2A (0.44) PDE2AKDM4EPKMHSD17B10IRAK4
SCHEMBL14048912 0.72 PDE2A (0.44) PDE2AKDM4EPKMHSD17B10IRAK4
SCHEMBL14033167 0.71 PDE2A (0.41) PDE2AKDM4EPKMHSD17B10IRAK4

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
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
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO 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 1409/4885TP53 4290/4885

“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.