SCHEMBL7388607

SCHEMBL7388607

NC(=NCl)Nc1cncc2cc(Sc3ccccc3)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.37
SIRT1 Q96EB6 4/20 0.36
SIRT2 Q8IXJ6 3/20 0.36
SIRT3 Q9NTG7 3/20 0.36
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
EGLN2 Q96KS0 3/20 0.35
EGLN1 Q9GZT9 3/20 0.35
LRRK2 Q5S007 1/20 0.35
SIGMAR1 Q99720 3/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
GCK P35557 1/20 0.33

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
SCHEMBL7387493 0.78 NAMPT (0.38) LMNA
SCHEMBL7371811 0.74 PLAU (0.41) LMNACYP1A2
Hydrochloric Acid SCHEMBL7379850 0.73 PLAU (0.40) LMNACYP1A2
SCHEMBL7388605 0.72 SIRT2 (0.37) ABL1SIRT1SIRT2SIRT3ICAM1
SCHEMBL7383159 0.71 PLG (0.55) MEN1LMNAKMT2A
Hydrochloric Acid SCHEMBL7377310 0.71 PLG (0.54) MEN1LMNAKMT2A
SCHEMBL7378246 0.70 CA1 (0.42) EGLN2EGLN1
SCHEMBL7368090 0.69 PLAU (0.51) MAPTMEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL7365698 0.69 PLAU (0.50) MAPTMEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL7366875 0.69 PLAU (0.42)

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