SCHEMBL22678116

SCHEMBL22678116

C=CC(=O)Nc1ccc(-c2c(-c3ccc(Oc4ccccc4)cc3)c3c(C)ncnc3n2C(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.50
▸ BTK Q06187 17/20 0.47
▸ EGFR P00533 6/20 0.47
▸ BLK P51451 2/20 0.47
▸ ERBB2 P04626 2/20 0.47
▸ RET P07949 1/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ FLT3 P36888 1/20 0.47
▸ TEC P42680 1/20 0.47
▸ TXK P42681 1/20 0.47
▸ BMX P51813 1/20 0.47
▸ ITK Q08881 1/20 0.47
▸ ERBB4 Q15303 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ MAP2K7 O14733 1/20 0.43

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
SCHEMBL30303291 1.00 TGM2 (0.50) TGM2BTKEGFRBLKERBB2
SCHEMBL26086108 0.89 MAPT (0.41) BTKEGFRBLKERBB2RET
SCHEMBL22677015 0.89 TGM2 (0.53) TGM2BTKEGFRBLKERBB2
SCHEMBL22675866 0.81 FGFR1 (0.46) TGM2BTKEGFRBLKERBB2
SCHEMBL22676399 0.79 BTK (0.61) BTKEGFRBLKERBB2RET
SCHEMBL30304003 0.78 MAP2K7 (0.46) TGM2BTKEGFRBLKERBB2
SCHEMBL22677034 0.78 MAP2K7 (0.46) TGM2BTKEGFRBLKERBB2
SCHEMBL22677214 0.78 TGM2 (0.55) TGM2BTKEGFRERBB2KCNH2
SCHEMBL22677208 0.74 BTK (0.39) BTKEGFRBLKERBB2RET
SCHEMBL22676650 0.73 BTK (0.55) BTKEGFRBLKERBB2RET

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 7 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-20230192709-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-06-22 — — US disclosed
US-20230192709-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-06-22 — — 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 (3 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-20230192709-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 TGM2 529/4885BTK 39/4885EGFR 16/4885
US-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 TGM2 529/4885BTK 39/4885EGFR 16/4885
US-11780845-B2 FGFR inhibitors and methods of use thereof FGFR3, FGFR2, FGFR1 TGM2 529/4885BTK 39/4885EGFR 16/4885

“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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