SCHEMBL2074968

SCHEMBL2074968

COc1cc(-c2cn(C3CCCC3)c3ncnc(Cl)c23)ccc1NC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 8/20 0.48
EGFR P00533 8/20 0.48
ABL1 P00519 6/20 0.48
ABL2 P42684 6/20 0.48
KDR P35968 5/20 0.47
RET P07949 3/20 0.47
KIF5B P33176 3/20 0.47
KCNH2 Q12809 1/20 0.47
CCDC6 Q16204 1/20 0.47
TEK Q02763 5/20 0.47
LCK P06239 4/20 0.47
ERBB2 P04626 1/20 0.45
ERBB3 P21860 1/20 0.45
ERBB4 Q15303 1/20 0.45
RIPK2 O43353 4/20 0.44
NEK7 Q8TDX7 2/20 0.44
LYN P07948 2/20 0.43
JAK2 O60674 1/20 0.43
NTRK1 P04629 1/20 0.43
INSR P06213 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
SCHEMBL6867277 0.92 EIF2AK3 (0.47) SRCKDRRETKIF5BKCNH2
SCHEMBL7006035 0.91 SRC (0.49) SRCEGFRABL1ABL2KDR
SCHEMBL2074527 0.89 ABL1 (0.50) SRCEGFRABL1ABL2KDR
SCHEMBL6871561 0.88 RET (0.44) SRCEGFRABL1ABL2KDR
SCHEMBL2074179 0.83 SRC (0.59) SRCEGFRABL1ABL2KDR
SCHEMBL6867323 0.81 ABL1 (0.48) SRCEGFRABL1ABL2KDR
SCHEMBL16930842 0.81 TEK (0.56) SRCEGFRABL1ABL2KDR
SCHEMBL7005371 0.80 TEK (0.61) SRCEGFRABL1ABL2KDR
SCHEMBL6460212 0.79 TEK (0.74) SRCEGFRABL1KDRRET
SCHEMBL6867388 0.79 ABL1 (0.45) SRCEGFRABL1ABL2KDR

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 SRC 89/4885EGFR 294/4885ABL1 189/4885

“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.