SCHEMBL5149238

SCHEMBL5149238

CN(CCN1CCCC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.72
CXCR4 P61073 2/20 0.57
PTGES O14684 1/20 0.49
CCR5 P51681 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
SRC P12931 1/20 0.46
KMT2A Q03164 1/20 0.46
HRH3 Q9Y5N1 2/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
HTR7 P34969 1/20 0.45

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
SCHEMBL28092811 0.89 SIGMAR1 (0.58) SIGMAR1CXCR4PTGESCCR5HTR2A
SCHEMBL28092846 0.87 MEN1 (0.58) SIGMAR1PTGESCCR5KMT2A
SCHEMBL14468188 0.86 SIGMAR1 (0.74) SIGMAR1CXCR4HTR2AHTR2CSRC
SCHEMBL27746879 0.85 SIGMAR1 (0.68) SIGMAR1CXCR4SRCKMT2A
SCHEMBL4271065 0.85 SIGMAR1 (0.97) SIGMAR1CXCR4SRCPSEN1PSEN2
SCHEMBL6338588 0.83 SIGMAR1 (0.62) SIGMAR1CXCR4HTR2AHTR2CKMT2A
SCHEMBL5431476 0.83 SIGMAR1 (0.59) SIGMAR1CXCR4SRC
SCHEMBL14445631 0.82 SIGMAR1 (0.69) SIGMAR1CXCR4HTR2AHTR2CSRC
SCHEMBL5167539 0.81 SIGMAR1 (0.52) SIGMAR1CXCR4KMT2AHRH3PSEN1
SCHEMBL15830503 0.80 SIGMAR1 (0.58) SIGMAR1CXCR4HTR2AHTR2CSRC

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
CN-101426772-B Benzotriazine inhibitors of kinases TARGEGEN INC 2014-01-08 CN disclosed
EP-1809614-A2 BENZOTRIAZINE INHIBITORS OF KINASES Targegen, Inc. (US) 2007-07-25 EP disclosed
WO-2005096784-A2 BENZOTRIAZINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2005-10-20 WO disclosed