SCHEMBL22625634

SCHEMBL22625634

C=Nc1nc(NC)ncc1/C=C(\C)c1cc(NC(=O)c2ccnc(C(F)(F)F)c2)ccc1C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 9/20 0.45
▸ JAK3 P52333 4/20 0.45
▸ KDR P35968 4/20 0.45
▸ MAPK14 Q16539 4/20 0.45
▸ BTK Q06187 9/20 0.43
▸ BMX P51813 2/20 0.43
▸ BLK P51451 2/20 0.43
▸ EGFR P00533 1/20 0.43
▸ ERBB2 P04626 1/20 0.43
▸ TEC P42680 1/20 0.43
▸ TXK P42681 1/20 0.43
▸ ERBB4 Q15303 1/20 0.43
▸ BRAF P15056 6/20 0.43
▸ RAF1 P04049 3/20 0.43
▸ TEK Q02763 1/20 0.41
▸ CSF1R P07333 1/20 0.41

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
SCHEMBL26165678 0.79 LCK (0.50) LCKJAK3KDRMAPK14BTK
SCHEMBL26165703 0.75 RAF1 (0.46) LCKMAPK14BRAFRAF1
SCHEMBL22625546 0.73 BTK (0.41) JAK3BTKBMXBLKEGFR
SCHEMBL22612763 0.72 LCK (0.61) LCKJAK3KDRMAPK14BRAF
SCHEMBL30439800 0.72 LCK (0.61) LCKJAK3KDRMAPK14BRAF
SCHEMBL22612843 0.72 LCK (0.51) LCKJAK3KDRMAPK14BRAF
SCHEMBL29427327 0.72 LCK (0.51) LCKJAK3KDRMAPK14BRAF
SCHEMBL30440409 0.72 LCK (0.54) LCKJAK3KDRMAPK14BRAF
SCHEMBL29427269 0.72 RAF1 (0.55) LCKJAK3KDRMAPK14BRAF
SCHEMBL22612830 0.72 LCK (0.54) LCKJAK3KDRMAPK14BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10927111-B2 Inhibitors of RAF kinases KINNATE BIOPHARMA INC. (US) 2021-02-23 — — US disclosed
US-20200347052-A1 INHIBITORS OF RAF KINASES Pierre Fabre Médicament (FR) 2020-11-05 — — 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-20200347052-A1 INHIBITORS OF RAF KINASES BRAF, RAF1, NRAS LCK 19/4885JAK3 349/4885KDR 113/4885
US-10927111-B2 Inhibitors of RAF kinases BRAF, RAF1, NRAS LCK 19/4885JAK3 349/4885KDR 113/4885

“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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