SCHEMBL31523722

SCHEMBL31523722

CNC/C=C/C(=O)N1C[C@@H]2C(C#Cc3c(-c4ccc(Oc5cccc(C)n5)cc4)c4c(N)ncnc4n3C)[C@@H]2C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 15/20 0.38
▸ FGFR2 P21802 4/20 0.38
▸ EGFR P00533 4/20 0.37
▸ ITK Q08881 4/20 0.37
▸ LCK P06239 3/20 0.37
▸ JAK3 P52333 1/20 0.36

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
SCHEMBL24458649 1.00 BTK (0.38) BTKFGFR2EGFRITKLCK
SCHEMBL24459065 0.91 BTK (0.48) BTKFGFR2EGFRITKLCK
SCHEMBL31523955 0.91 BTK (0.48) BTKFGFR2EGFRITKLCK
SCHEMBL24458513 0.89 FGFR2 (0.39) FGFR2ITK
SCHEMBL31523769 0.88 BTK (0.43) BTKEGFR
SCHEMBL24458921 0.88 BTK (0.43) BTKEGFR
SCHEMBL31524081 0.87 FGFR2 (0.46) BTKFGFR2EGFRITKLCK
SCHEMBL24459064 0.87 FGFR2 (0.46) BTKFGFR2EGFRITKLCK
SCHEMBL24458544 0.84 BTK (0.47) BTKEGFRITKLCKJAK3
SCHEMBL31523720 0.84 BTK (0.47) BTKEGFRITKLCKJAK3

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-20250154154-A1 SRC INHIBITORS AND USES THEREOF RELAY THERAPEUTICS, INC. 2025-05-15 — — 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-20250154154-A1 SRC INHIBITORS AND USES THEREOF SRC, LCK, FYN BTK 7/4885FGFR2 220/4885EGFR 51/4885

“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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