SCHEMBL7387489

SCHEMBL7387489

N=C(N)N(Cl)c1cncc2cc(S(=O)(=O)c3ccccc3)ccc12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.36
FEN1 P39748 1/20 0.34
NAMPT P43490 5/20 0.34
CYP2C9 P11712 2/20 0.34
C1S P09871 2/20 0.33
HTR6 P50406 2/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32

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
SCHEMBL7373625 0.88 MEN1 (0.31)
SCHEMBL7380233 0.85 PLAU (0.39)
Hydrochloric Acid SCHEMBL7379848 0.84 PLAU (0.38)
Hydrochloric Acid SCHEMBL7386017 0.80 PLAU (0.46) L3MBTL1
SCHEMBL6436458 0.80 PLG (0.52)
Hydrochloric Acid SCHEMBL7366869 0.79 PLAU (0.41)
Hydrochloric Acid SCHEMBL6433178 0.79 PLG (0.51)
SCHEMBL6434174 0.78 PLAU (0.50)
Hydrochloric Acid SCHEMBL6437764 0.77 PLAU (0.49)
Hydrochloric Acid SCHEMBL7376136 0.77 PLAU (0.48) FEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023268-A1 ISOQUINOLINES AS UROKINASE INHIBITORS Pfizer Limited (GB) 2000-08-02 EP disclosed
WO-1999020608-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LIMITED (GB) 1999-04-29 WO disclosed