SCHEMBL22772382

SCHEMBL22772382

Nc1n[nH]c2cccc(C#Cc3cccc(C(=O)Nc4ccc(CN5CCOCC5)c(C(F)(F)F)c4)c3)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 15/20 1.00
▸ BCR P11274 14/20 1.00
▸ SRC P12931 3/20 0.70
▸ CSF1R P07333 1/20 0.70
▸ BRAF P15056 1/20 0.70
▸ FLT3 P36888 1/20 0.70
▸ KCNH2 Q12809 1/20 0.70
▸ FGFR1 P11362 1/20 0.57
▸ KDR P35968 1/20 0.57
▸ KIT P10721 2/20 0.53

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
SCHEMBL22772360 0.92 ABL1 (0.85) ABL1BCRSRCCSF1RBRAF
SCHEMBL22788769 0.86 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF
SCHEMBL16755317 0.83 KIT (0.72) ABL1BCRSRCFGFR1KIT
SCHEMBL22788745 0.83 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF
SCHEMBL22772364 0.82 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF
SCHEMBL22772372 0.80 ABL1 (0.65) ABL1BCRSRCBRAFKCNH2
SCHEMBL21730532 0.79 ABL1 (0.70) ABL1BCRSRCFGFR1KDR
SCHEMBL22772390 0.79 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF
SCHEMBL22772381 0.78 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF
SCHEMBL22772361 0.78 ABL1 (1.00) ABL1BCRSRCCSF1RBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11407745-B2 Indazole derivatives and pharmaceutical composition for preventing, alleviating or treating cancer containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2022-08-09 — — US disclosed
US-20200392127-A1 NOVEL INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR PREVENTING, ALLEVIATING OR TREATING CANCER CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2020-12-17 — — US disclosed
US-20200392127-A1 NOVEL INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR PREVENTING, ALLEVIATING OR TREATING CANCER CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2020-12-17 — — 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 (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-20200392127-A1 NOVEL INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR PREVENTING, ALLEVIATING OR TREATING CANCER CONTAINING THE SAME ABL1, DDR1, ABL2 ABL1 1/4885BCR 10/4885SRC 14/4885
US-11407745-B2 Indazole derivatives and pharmaceutical composition for preventing, alleviating or treating cancer containing the same ABL1, DDR1, ABL2 ABL1 1/4885BCR 9/4885SRC 11/4885

“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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