SCHEMBL19981559

SCHEMBL19981559

CN1CCn2nc(Nc3cc(N4CCCPC4)nn(C)c3=O)cc2C1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.41
SYK P43405 1/20 0.34
FGR P09769 1/20 0.33
SRC P12931 1/20 0.33
TEC P42680 1/20 0.33
BMX P51813 1/20 0.33
CSF1R P07333 1/20 0.31
CDK4 P11802 1/20 0.31
CDK6 Q00534 1/20 0.31

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
SCHEMBL19981572 0.88 BTK (0.44) BTKSYKFGRSRCTEC
SCHEMBL19981933 0.88 BTK (0.44) BTKSYKFGRSRCTEC
SCHEMBL19981898 0.78 BTK (0.36) BTK
SCHEMBL16357030 0.78 BTK (0.47) BTKSYKFGRSRCTEC
SCHEMBL10262845 0.78 BTK (0.49) BTKSYKFGRSRCTEC
SCHEMBL255495 0.77 BTK (0.46) BTKSYKFGRSRCTEC
SCHEMBL14929644 0.74 BTK (0.44) BTKSYKFGRSRCTEC
SCHEMBL9984843 0.72 BTK (0.47) BTKSYK
SCHEMBL2490655 0.71 BTK (0.47) BTKSYK
SCHEMBL2488047 0.71 SYK (0.37) BTKSYKFGRSRCTEC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed