SCHEMBL7006736

SCHEMBL7006736

Nc1ncnc2c1c(-c1ccc(NS(=O)(=O)c3ccccc3)c(O)c1)cn2C1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEK Q02763 5/20 0.65
SRC P12931 11/20 0.60
EGFR P00533 10/20 0.60
ABL1 P00519 9/20 0.60
ABL2 P42684 9/20 0.60
LCK P06239 5/20 0.59
KDR P35968 5/20 0.59
IGF1R P08069 3/20 0.59
LYN P07948 2/20 0.59
JAK2 O60674 1/20 0.59
NTRK1 P04629 1/20 0.59
INSR P06213 1/20 0.59
NPM1 P06748 1/20 0.59
CSF1R P07333 1/20 0.59
RET P07949 1/20 0.59
MET P08581 1/20 0.59
ROS1 P08922 1/20 0.59
PDGFRB P09619 1/20 0.59
KIT P10721 1/20 0.59
BCR P11274 1/20 0.59

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
SCHEMBL12934116 0.92 TEK (0.57) TEKSRCEGFRABL1ABL2
SCHEMBL12934112 0.92 SRC (0.56) TEKSRCEGFRABL1ABL2
SCHEMBL12934118 0.92 SRC (0.56) TEKSRCEGFRABL1ABL2
SCHEMBL2074422 0.90 SRC (0.67) TEKSRCEGFRABL1ABL2
SCHEMBL12934131 0.90 TEK (0.63) TEKSRCEGFRABL1ABL2
SCHEMBL12934129 0.90 TEK (0.65) TEKSRCEGFRABL1ABL2
SCHEMBL2074647 0.90 TEK (0.65) TEKSRCEGFRABL1ABL2
SCHEMBL12934117 0.89 SRC (0.66) TEKSRCEGFRABL1ABL2
SCHEMBL7005208 0.89 TEK (0.55) TEKSRCEGFRABL1ABL2
SCHEMBL12934136 0.89 TEK (0.62) TEKSRCEGFRABL1ABL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1134439-C Pyrrolo [2,3D ] pyrimidines and their use as tyrosine kinase inhibitors 艾博特股份有限两合公司 2004-01-14 CN claimed
EP-0970084-B1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AG (DE) 2003-06-04 EP claimed
CN-1259950-A Pyrrolo [2,3D] pyrimidines and their use as tyrosine kinase inhibitors BASF AG (DE) 2000-07-12 CN claimed
EP-0970084-B1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AG (DE) 2003-06-04 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