SCHEMBL31213852

SCHEMBL31213852

C=C(C)C(=O)Nc1ccc(-c2nn3ncnc(N)c3c2-c2ccc(Oc3cccc(C)n3)c(F)c2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ FGFR1 P11362 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ FGFR2 P21802 1/20 0.50
▸ FGFR4 P22455 1/20 0.50
▸ FGFR3 P22607 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ JAK3 P52333 8/20 0.36
▸ MET P08581 4/20 0.36
▸ RAF1 P04049 2/20 0.35
▸ KIT P10721 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ AXL P30530 2/20 0.34
▸ MERTK Q12866 2/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ MAPK3 P27361 1/20 0.33

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
SCHEMBL31213915 0.94 CYP3A4 (0.44) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213843 0.93 FGFR1 (0.54) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31214005 0.90 FGFR1 (0.43) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31214014 0.90 CYP3A4 (0.61) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213930 0.89 FGFR1 (0.43) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213971 0.89 CYP3A4 (0.43) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213941 0.88 CYP3A4 (0.45) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213904 0.87 FGFR1 (0.47) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213934 0.87 FGFR1 (0.47) CYP3A4CYP2D6FGFR1CYP2C9FGFR2
SCHEMBL31213876 0.85 FGFR1 (0.60) CYP3A4CYP2D6FGFR1CYP2C9FGFR2

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-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF 3H PHARMACEUTICALS CO., LTD. (CN) 2024-11-21 — — US claimed
US-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF 3H PHARMACEUTICALS CO., LTD. (CN) 2024-11-21 — — 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 (1 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-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR1, FGFR3, FGFR4 CYP3A4 594/4885CYP2D6 638/4885FGFR1 1/4885

“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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