SCHEMBL21893429

SCHEMBL21893429

CC(C)c1n[nH]c2ncc(F)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.32
JAK3 P52333 2/20 0.32
MAPK14 Q16539 1/20 0.32
CYP1A2 P05177 1/20 0.32
GRM4 Q14833 1/20 0.32
GSK3A P49840 8/20 0.32
GSK3B P49841 8/20 0.32
ROCK2 O75116 1/20 0.32
SRC P12931 1/20 0.32
CDK2 P24941 1/20 0.32
KDR P35968 1/20 0.32
FLT3 P36888 1/20 0.32
PIK3CG P48736 1/20 0.32
PLK1 P53350 1/20 0.32
ROCK1 Q13464 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
P2RX7 Q99572 1/20 0.32
RIPK2 O43353 1/20 0.31
KCNH2 Q12809 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL22201937 0.81 GSK3A (0.30) GSK3AGSK3B
SCHEMBL1496185 0.79 GSK3B (0.36) GSK3B
SCHEMBL27215058 0.79 DYRK1B (0.41) JAK2JAK3GSK3AGSK3BROCK2
SCHEMBL30806243 0.77 GRM4 (0.39) CYP1A2GRM4GSK3AGSK3BPIM1
SCHEMBL14070089 0.77 GRM4 (0.39) CYP1A2GRM4GSK3AGSK3BPIM1
SCHEMBL19209822 0.76
SCHEMBL30440210 0.74 RET (0.38) JAK2CYP1A2GRM4GSK3AGSK3B
SCHEMBL175432 0.74 RET (0.38) JAK2CYP1A2GRM4GSK3AGSK3B
SCHEMBL2438325 0.74 PDPK1 (0.40) JAK2MAPK14CYP1A2GRM4GSK3A
SCHEMBL25843864 0.74 MAPK14 (0.33) MAPK14P2RX7

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-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-24 US disclosed
WO-2021191359-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 WO disclosed
WO-2020065613-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 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-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP11B2, WEE2, CYP11B1 JAK2 675/4885JAK3 3085/4885MAPK14 784/4885

“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.