SCHEMBL25545932

SCHEMBL25545932

COc1cc(-c2nc(Cl)sc2CC(C)C)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.44
DYRK1A Q13627 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
S1PR1 P21453 1/20 0.38
TRPV1 Q8NER1 1/20 0.36
ALDH1A1 P00352 3/20 0.36
RIPK2 O43353 1/20 0.36
GRM2 Q14416 6/20 0.36
KMO O15229 1/20 0.36
EGLN2 Q96KS0 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPK1 P28482 1/20 0.34
PGK1 P00558 1/20 0.34

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
SCHEMBL25545941 0.91 LMNA (0.48) FBP1MAPTLMNAS1PR1ALDH1A1
SCHEMBL25546325 0.89 S1PR1 (0.50) FBP1MAPTLMNAS1PR1ALDH1A1
SCHEMBL25545938 0.88 DYRK1A (0.39) DYRK1AMAPTLMNATRPV1ALDH1A1
SCHEMBL25545928 0.88 FBP1 (0.42) FBP1MAPTLMNAS1PR1ALDH1A1
SCHEMBL25546030 0.88 FBP1 (0.42) FBP1MAPTLMNAS1PR1TRPV1
SCHEMBL25183737 0.87 FBP1 (0.45) FBP1MAPTTRPV1ALDH1A1MAPK1
SCHEMBL25546375 0.86 FBP1 (0.44) FBP1MAPTLMNAS1PR1ALDH1A1
SCHEMBL18282312 0.85 FBP1 (0.48) FBP1MAPTLMNAALDH1A1KDM4E
SCHEMBL25545925 0.85 ALDH1A1 (0.42) FBP1MAPTLMNAS1PR1ALDH1A1
SCHEMBL25546067 0.82 RIPK2 (0.41) DYRK1AMAPTLMNAALDH1A1RIPK2

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-20230150997-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. 2023-05-18 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-20230150997-A1 EIF4E INHIBITORS AND USES THEREOF EIF4E, EIF4EBP1, EIF4A1 FBP1 735/4885DYRK1A 3417/4885MAPT 2231/4885

“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.