SCHEMBL22925944

SCHEMBL22925944

Cn1nc(-c2ccc(C(F)(F)F)cn2)cc1N

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 9/20 0.41
KDM4E B2RXH2 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KIF11 P52732 1/20 0.40
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.38
GCK P35557 1/20 0.36
GCKR Q14397 1/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
TRPV3 Q8NET8 1/20 0.35
NOS3 P29474 1/20 0.35
NOS2 P35228 1/20 0.35
BACE1 P56817 1/20 0.35
KDM1A O60341 1/20 0.35
MAOB P27338 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
SCHEMBL29621133 1.00 PDE2A (0.41) PDE2AKDM4ENPSR1KIF11ALDH1A1
SCHEMBL26847586 0.84 PDE2A (0.41) PDE2AKDM4ENPSR1KIF11ALDH1A1
SCHEMBL22925836 0.79 PDE2A (0.40) PDE2AKDM4ENPSR1KIF11ALDH1A1
SCHEMBL25407644 0.79 CSNK1D (0.40) ALDH1A1KMT2A
SCHEMBL4681659 0.79 NPY5R (0.46) KDM4ENPSR1KIF11ALDH1A1KMT2A
SCHEMBL30567666 0.79 CSNK1D (0.40) ALDH1A1KMT2A
SCHEMBL29595709 0.77 NPSR1 (0.53) KDM4ENPSR1KIF11KMT2ATRPV3
SCHEMBL811160 0.77 NPSR1 (0.53) KDM4ENPSR1KIF11KMT2ATRPV3
SCHEMBL15048498 0.76 GRM5 (0.40) KDM4ENPSR1ALDH1A1KMT2ABACE1
SCHEMBL22659826 0.74 NOTUM (0.42) PDE2AKDM4EBACE1

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-20220274970-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-09-01 US disclosed
CN-114450281-A Inhibitor compounds 辛塞拉治疗私人有限公司 2022-05-06 CN disclosed
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 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-20220274970-A1 INHIBITOR COMPOUNDS SERPINB1, MMP1, SSB PDE2A 2451/4885KDM4E 1551/4885NPSR1 2967/4885

“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.