SCHEMBL22676018

SCHEMBL22676018

C=C(C)C(=O)Nc1ccc(-c2c(-c3ccc(Oc4cccc(C)n4)cc3)c3c(N)ncnn3c2C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 9/20 0.43
▸ KIT P10721 6/20 0.43
▸ FGFR1 P11362 3/20 0.43
▸ FGFR3 P22607 3/20 0.43
▸ NTRK2 Q16620 3/20 0.43
▸ NTRK1 P04629 2/20 0.43
▸ PLK4 O00444 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ DAPK3 O43293 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ PAK4 O96013 1/20 0.43
▸ CHEK2 O96017 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ INSR P06213 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ CSF1R P07333 1/20 0.43
▸ LYN P07948 1/20 0.43
▸ IGF1R P08069 1/20 0.43
▸ MET P08581 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
SCHEMBL30303480 1.00 KDR (0.43) KDRKITFGFR1FGFR3NTRK2
SCHEMBL22676841 0.90 KDR (0.50) KDRKITFGFR1FGFR3NTRK2
SCHEMBL30303333 0.90 KDR (0.50) KDRKITFGFR1FGFR3NTRK2
SCHEMBL22676017 0.87 KDR (0.44) KDRKITFGFR1FGFR3NTRK2
SCHEMBL30303770 0.87 KDR (0.44) KDRKITFGFR1FGFR3NTRK2
SCHEMBL22675820 0.86 KDR (0.44) KDRKITFGFR1FGFR3NTRK2
SCHEMBL30303274 0.86 KDR (0.43) KDRKITFGFR1FGFR3NTRK2
SCHEMBL22676849 0.86 KDR (0.43) KDRKITFGFR1FGFR3NTRK2
SCHEMBL30303526 0.86 KDR (0.44) KDRKITFGFR1FGFR3NTRK2
SCHEMBL22658711 0.83 FGFR1 (0.42) KDRKITFGFR1FGFR3NTRK2

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 KDR 80/4885KIT 552/4885FGFR1 3/4885
US-20230104574-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR3, FGFR2, FGFR1 KDR 80/4885KIT 552/4885FGFR1 3/4885
US-11780845-B2 FGFR inhibitors and methods of use thereof FGFR3, FGFR2, FGFR1 KDR 80/4885KIT 552/4885FGFR1 3/4885

“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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