SCHEMBL7009432

SCHEMBL7009432

OCC(O)Cn1cc(-c2ccc(Oc3ccccc3)cc2)c2c(Cl)ncnc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.55
LCK P06239 9/20 0.55
TEK Q02763 8/20 0.55
KDR P35968 7/20 0.46
BTK Q06187 5/20 0.43
FYN P06241 2/20 0.41
LYN P07948 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
RGS12 O14924 1/20 0.41
NPC1 O15118 1/20 0.41
GMNN O75496 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EGFR P00533 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 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
SCHEMBL7007367 0.87 SRC (0.73) SRCLCKTEKKDRBTK
SCHEMBL23873552 0.81 TEK (0.56) SRCLCKTEKKDRBTK
SCHEMBL7009149 0.73 DYRK3 (0.52) SRCLMNASMN1; SMN2FLT3PRKD3
SCHEMBL30143854 0.72 TEK (0.48) SRCLCKTEKKDREGFR
SCHEMBL23834473 0.72 TEK (0.48) SRCLCKTEKKDREGFR
SCHEMBL6461069 0.72 SRC (0.62) SRCLCKTEKKDRBTK
SCHEMBL6461297 0.72 SRC (0.62) SRCLCKTEKKDRBTK
SCHEMBL6461085 0.72 SRC (0.62) SRCLCKTEKKDRBTK
SCHEMBL7006747 0.71 SRC (1.00) SRCLCKTEKKDRBTK
SCHEMBL7850708 0.71 SRC (0.66) SRCLCKTEKKDRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970084-B1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AG (DE) 2003-06-04 EP disclosed
EP-0970084-A1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-01-12 EP disclosed
US-6001839-A Substituted 4-amino-7H-pyrrolo [2,3,-d]-pyrimidines as PTK inhibitors BASF AKTIENGESELLSCHAFT (DE) 1999-12-14 US disclosed
WO-1998041525-A1 PYRROLO[2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed