SCHEMBL31523339

SCHEMBL31523339

COc1c(NN)ccc(Br)c1F

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ CA2 P00918 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA4 P22748 1/20 0.31
▸ NQO2 P16083 1/20 0.31
▸ MEP1B Q16820 1/20 0.31
▸ HTR2A P28223 2/20 0.30
▸ KDM1A O60341 2/20 0.30
▸ KCNH2 Q12809 2/20 0.30
▸ KDM1B Q8NB78 2/20 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
Hydrochloric Acid SCHEMBL31523285 0.98 ALOX5AP (0.38) ALOX5APFEN1CA2CA1CA9
Hydrochloric Acid SCHEMBL25343166 0.79 JAK2 (0.36) CA2CA1CA9MEP1BHTR2A
SCHEMBL21468519 0.76 KMT2A (0.39) MEP1B
SCHEMBL1675886 0.75 ALOX5AP (0.49) ALOX5APFEN1CA2CA4NQO2
SCHEMBL29509682 0.74 MEP1B (0.44) ALOX5APFEN1CA2CA1CA4
SCHEMBL4024514 0.74 MEP1B (0.44) ALOX5APFEN1CA2CA1CA4
Hydrochloric Acid SCHEMBL28339215 0.74 KDM1A (0.38) CA2CA1CA9KDM1AKCNH2
SCHEMBL15561571 0.73 EGFR (0.43) CA2CA1CA9CA4NQO2
SCHEMBL31523571 0.73 CA2 (0.34) CA2CA4
SCHEMBL4574409 0.72 TUBB1 (0.41) ALOX5APFEN1CA2CA4NQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346600-A1 TRICYCLIC DERIVATIVES AND RELATED USES MOMA THERAPEUTICS, INC. 2025-11-13 — — US disclosed
WO-2025054488-A1 TRICYCLIC DERIVATIVES AND RELATED USES MOMA THERAPEUTICS, INC. (US) 2025-03-13 — — 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-20250346600-A1 TRICYCLIC DERIVATIVES AND RELATED USES WRN, RECQL, BLM ALOX5AP 3375/4885FEN1 27/4885CA2 4248/4885

“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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