SCHEMBL24704591

SCHEMBL24704591

Fc1ccc(F)c(-c2ncn(Cc3cnc4ncn(C5CC5)c4c3)c2C2CC2)c1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 4/20 0.32
▸ MAPK13 O15264 1/20 0.32
▸ MAPK12 P53778 1/20 0.32
▸ MAPK11 Q15759 1/20 0.32
▸ IL4I1 Q96RQ9 1/20 0.31
▸ PDE1C Q14123 1/20 0.31
▸ GABRA2 P47869 2/20 0.31
▸ EGFR P00533 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ MAPK10 P53779 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
SCHEMBL24704123 0.84 HTT (0.34) MAPK14KDM4EUSP2ALDH1A1PKM
SCHEMBL22862452 0.81 — —
SCHEMBL22862438 0.77 ALDH1A1 (0.40) MAPK14KDM4EUSP2ALDH1A1LMNA
SCHEMBL22862777 0.76 KDM4E (0.37) MAPK14PDE1CKDM4EALDH1A1LMNA
SCHEMBL24704592 0.76 TNIK (0.35) MAPK14MAPK13MAPK12MAPK11GABRA2
SCHEMBL22862877 0.75 SIGMAR1 (0.39) —
SCHEMBL24704416 0.71 SMN1; SMN2 (0.39) KDM4EALDH1A1PKM
SCHEMBL22862994 0.69 KDM4E (0.37) MAPK14PDE1CKDM4EALDH1A1MAPT
SCHEMBL22862770 0.69 KDM4E (0.33) MAPK14PDE1CKDM4EALDH1A1
SCHEMBL24704121 0.68 CDK9 (0.41) KDM4EALDH1A1

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 MAPK14 765/4885MAPK13 1779/4885MAPK12 2006/4885

“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.

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