SCHEMBL22676388

SCHEMBL22676388

C=CC(=O)N1CCC(c2c(-c3ccc(COC)cc3)c3c(N)ncnc3n2C)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ITK Q08881 4/20 0.49
▸ FGFR1 P11362 3/20 0.47
▸ FGFR4 P22455 1/20 0.47
▸ EGFR P00533 2/20 0.47
▸ BTK Q06187 7/20 0.47
▸ JAK2 O60674 3/20 0.47
▸ JAK1 P23458 3/20 0.47
▸ TYK2 P29597 3/20 0.47
▸ JAK3 P52333 3/20 0.47
▸ FGFR2 P21802 4/20 0.46
▸ FGFR3 P22607 2/20 0.46
▸ RET P07949 2/20 0.46

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
SCHEMBL22676924 1.00 ITK (0.49) ITKFGFR1FGFR4EGFRBTK
SCHEMBL25231711 0.91 BTK (0.56) ITKFGFR1EGFRBTKJAK3
SCHEMBL22676329 0.91 BTK (0.56) ITKFGFR1EGFRBTKJAK3
SCHEMBL30303279 0.91 BTK (0.56) ITKFGFR1EGFRBTKJAK3
SCHEMBL22676206 0.89 ITK (0.60) ITKFGFR1FGFR4BTKFGFR2
SCHEMBL30303367 0.89 BTK (0.60) ITKFGFR1EGFRBTKJAK3
SCHEMBL26084486 0.89 BTK (0.60) ITKFGFR1EGFRBTKJAK3
SCHEMBL22677406 0.89 BTK (0.60) ITKFGFR1EGFRBTKJAK3
SCHEMBL22676275 0.89 ITK (0.51) ITKFGFR1FGFR4EGFRBTK
SCHEMBL22675813 0.89 ITK (0.49) ITKFGFR1FGFR4EGFRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306529-A2 FGFR INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2024-01-17 — — EP disclosed
US-11780845-B2 FGFR inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2023-10-10 — — US disclosed
US-11780845-B2 FGFR inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2023-10-10 — — US disclosed
US-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF D.E. SHAW RESEARCH, LLC 2023-04-06 — — US disclosed
WO-2020231990-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. (US) 2020-11-19 — — 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 (2 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-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 ITK 1273/4885FGFR1 3/4885FGFR4 4/4885
US-11780845-B2 FGFR inhibitors and methods of use thereof FGFR3, FGFR2, FGFR1 ITK 1273/4885FGFR1 3/4885FGFR4 4/4885

“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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