SCHEMBL2071828

SCHEMBL2071828

CC(C)(C)OC(=O)Nc1ccc(-c2cn(C3CCCC3)c3ncnc(Cl)c23)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.46
SRC P12931 14/20 0.44
RIPK2 O43353 2/20 0.44
EGFR P00533 7/20 0.43
ABL1 P00519 5/20 0.43
ABL2 P42684 5/20 0.43
KDR P35968 2/20 0.43
RET P07949 1/20 0.43
KIF5B P33176 1/20 0.43
KCNH2 Q12809 1/20 0.43
CCDC6 Q16204 1/20 0.43
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
RGS12 O14924 1/20 0.40
NPC1 O15118 1/20 0.40
GMNN O75496 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL2075315 0.89 SRC (0.57) FLT3SRCRIPK2EGFRABL1
SCHEMBL22418417 0.85 NEK7 (0.51) FLT3SRCRIPK2EGFRKDR
SCHEMBL2074527 0.84 ABL1 (0.50) FLT3SRCRIPK2EGFRABL1
SCHEMBL22086030 0.80 SRC (0.55) SRCEGFRABL1ABL2KDR
SCHEMBL6867323 0.77 ABL1 (0.48) SRCRIPK2EGFRABL1ABL2
SCHEMBL6865329 0.77 RET (0.43) SRCRIPK2EGFRABL1ABL2
SCHEMBL6872025 0.76 NEK7 (0.49) KDRRETKIF5BKCNH2CCDC6
SCHEMBL6867388 0.76 ABL1 (0.45) SRCRIPK2EGFRABL1ABL2
SCHEMBL2075155 0.76 SRC (0.48) FLT3SRCRIPK2EGFRABL1
SCHEMBL2072372 0.75 SRC (0.60) FLT3SRCRIPK2EGFRABL1

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-7863444-B2 4-aminopyrrolopyrimidines as kinase inhibitors ABBOTT LABORATORIES (US) 2011-01-04 US disclosed
EP-1114052-B1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBOTT GMBH & CO KG (DE) 2005-11-16 EP disclosed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 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-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 FLT3 201/4885SRC 89/4885RIPK2 1330/4885

“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.