SCHEMBL4437368

SCHEMBL4437368

NC(=O)CNC(=O)c1cnn2cc(Cc3cc(C(F)(F)F)ccc3Cl)cnc12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.42
RIPK1 Q13546 1/20 0.40
PDE2A O00408 14/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ABL1 P00519 1/20 0.39
CCR1 P32246 1/20 0.38
P2RX7 Q99572 1/20 0.38
PDE10A Q9Y233 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
SCHEMBL14033962 0.89 PDE2A (0.44) PDE2APDE10A
SCHEMBL14033455 0.88 IRAK4 (0.43) PDE2AKDM4EPKMHSD17B10PDE10A
SCHEMBL4434781 0.85 NR3C1 (0.47) PDE2AKDM4EPKMHSD17B10
SCHEMBL4437012 0.84 KLKB1 (0.42) PDE2AKDM4EPDE10A
SCHEMBL14033701 0.82 IRAK4 (0.43) PDE2AKDM4EPKMHSD17B10
SCHEMBL14033169 0.82 PDE2A (0.42) PDE2AKDM4EPKMHSD17B10
SCHEMBL14033696 0.81 IRAK4 (0.42) PDE2AKDM4EPKMHSD17B10PDE10A
SCHEMBL14033296 0.81 PDE2A (0.43) PDE2APDE10A
SCHEMBL14033447 0.81 HSD17B10 (0.47) PDE2AKDM4EPKMHSD17B10
SCHEMBL4439750 0.80 PDE2A (0.41) PDE2AKDM4EPKMHSD17B10PDE10A

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 5 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
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 MRGPRX4 1939/4885RIPK1 875/4885PDE2A 2511/4885

“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.