SCHEMBL2074490

SCHEMBL2074490

COc1cc(-c2cn(C3CCCC3)c3ncnc(N)c23)ccc1NC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 11/20 0.61
LCK P06239 7/20 0.61
KDR P35968 6/20 0.61
TEK Q02763 5/20 0.61
LIMK1 P53667 2/20 0.61
LIMK2 P53671 1/20 0.61
IGF1R P08069 5/20 0.59
EGFR P00533 9/20 0.56
ABL1 P00519 8/20 0.56
ABL2 P42684 8/20 0.56
LYN P07948 3/20 0.54
RET P07949 2/20 0.54
INSR P06213 2/20 0.54
CSF1R P07333 2/20 0.54
FGFR1 P11362 2/20 0.54
FLT3 P36888 2/20 0.54
BLK P51451 2/20 0.54
JAK2 O60674 1/20 0.54
NTRK1 P04629 1/20 0.54
NPM1 P06748 1/20 0.54

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
SCHEMBL6885605 0.97 SRC (0.58) SRCLCKKDRTEKLIMK1
SCHEMBL2071754 0.95 IGF1R (0.59) SRCLCKKDRTEKLIMK1
SCHEMBL6461905 0.93 LCK (0.59) SRCLCKKDRTEKLIMK1
SCHEMBL6461790 0.93 SRC (0.59) SRCLCKKDRTEKLIMK1
SCHEMBL2071878 0.92 SRC (0.53) SRCLCKKDRTEKLIMK1
SCHEMBL2072511 0.92 IGF1R (0.59) SRCLCKKDRTEKLIMK1
SCHEMBL2074582 0.92 IGF1R (0.60) SRCLCKKDRTEKLIMK1
Hydrochloric Acid SCHEMBL2071991 0.91 SRC (0.52) SRCLCKKDRTEKLIMK1
SCHEMBL6883793 0.91 LCK (0.76) SRCLCKKDRTEKLIMK1
SCHEMBL2074654 0.90 IGF1R (0.60) SRCLCKKDRTEKLIMK1

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 6 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-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 US disclosed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 US disclosed
EP-1114052-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017202-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO 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-20050008640-A1 Method of treating transplant rejection LCK, ZAP70, FYN SRC 46/4885LCK 1/4885KDR 3981/4885
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 SRC 89/4885LCK 1/4885KDR 140/4885

“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.