SCHEMBL24375045

SCHEMBL24375045

CCc1ccnc(NC2CC2)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 8/20 0.46
UTS2R Q9UKP6 1/20 0.41
IRAK4 Q9NWZ3 2/20 0.41
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
NSD2 O96028 1/20 0.39
BRD4 O60885 2/20 0.36
ATAD2 Q6PL18 2/20 0.36
GRM1 Q13255 1/20 0.36
FLT3 P36888 1/20 0.36
TYRO3 Q06418 1/20 0.36
MERTK Q12866 1/20 0.36
GAS6 Q14393 1/20 0.36
BTK Q06187 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
CHRM4 P08173 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
SCHEMBL21921087 0.78 LRRK2 (0.49) LRRK2UTS2RNOS1NOS2BRD4
SCHEMBL25713746 0.78 ALDH1A1 (0.37) KDM4EALDH1A1
SCHEMBL15966089 0.77 GRM4 (0.42) LRRK2UTS2RIRAK4NOS2TYRO3
SCHEMBL24857977 0.76 JAK2 (0.47) MEN1KMT2A
SCHEMBL24375255 0.76 LRRK2 (0.39) LRRK2UTS2RIRAK4NOS1NOS2
SCHEMBL23001463 0.75 LRRK2 (0.42) LRRK2UTS2RBRD4ATAD2KDM4E
SCHEMBL30082304 0.75 LRRK2 (0.42) LRRK2UTS2RMEN1ALDH1A1KMT2A
SCHEMBL18328240 0.75 LRRK2 (0.42) LRRK2UTS2RIRAK4MEN1ALDH1A1
SCHEMBL29734745 0.75 LRRK2 (0.42) LRRK2UTS2RBRD4ATAD2KDM4E
SCHEMBL23811546 0.74 LRRK2 (0.42) LRRK2UTS2RIRAK4NSD2BRD4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220127271-A1 NITROGEN-CONTAINING FUSED HETEROCYCLIC SHP2 INHIBITOR COMPOUND, PREPARATION METHOD, AND USE SHANGHAI RINGENE BIOPHARMA CO., LTD. (CN) 2022-04-28 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-20220127271-A1 NITROGEN-CONTAINING FUSED HETEROCYCLIC SHP2 INHIBITOR COMPOUND, PREPARATION METHOD, AND USE PTPN1, PTPN7, PTPN9 LRRK2 850/4885UTS2R 1873/4885IRAK4 2107/4885

“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.