SCHEMBL24704592

SCHEMBL24704592

Fc1ccc(F)c(-c2ncn(Cc3ccc4ncn(C5CC5)c4n3)c2C2CC2)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TNIK Q9UKE5 1/20 0.35
▸ GABRA2 P47869 5/20 0.33
▸ MAPK14 Q16539 5/20 0.32
▸ MAPK13 O15264 1/20 0.32
▸ MAPK12 P53778 1/20 0.32
▸ MAPK11 Q15759 1/20 0.32
▸ NUAK1 O60285 1/20 0.31
▸ CHKA P35790 1/20 0.30

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
SCHEMBL24704121 0.85 CDK9 (0.41) —
SCHEMBL22862452 0.82 — —
SCHEMBL24704591 0.76 MAPK14 (0.32) GABRA2MAPK14MAPK13MAPK12MAPK11
SCHEMBL24704416 0.75 SMN1; SMN2 (0.39) —
SCHEMBL22862438 0.74 ALDH1A1 (0.40) MAPK14
SCHEMBL22862877 0.74 SIGMAR1 (0.39) —
SCHEMBL24704593 0.74 HCAR1 (0.31) —
SCHEMBL24704123 0.70 HTT (0.34) MAPK14
SCHEMBL24704122 0.67 CDK9 (0.39) —
SCHEMBL22862777 0.67 KDM4E (0.37) MAPK14

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-20220389028-A1 BAX INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY 2022-12-08 — — 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-20220389028-A1 BAX INHIBITORS AND USES THEREOF BAX, TMBIM6, BCL2 TNIK 632/4885GABRA2 3433/4885MAPK14 765/4885

“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.

Send feedback