SCHEMBL7378246

SCHEMBL7378246

NC(=NCl)Nc1cncc2cc(C(=O)NCCC(=O)O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CSNK2A2 P19784 2/20 0.41
CSNK2B P67870 2/20 0.41
CSNK2A1 P68400 2/20 0.41
CSNK2A3 Q8NEV1 2/20 0.41
EGLN2 Q96KS0 5/20 0.40
ITGB3 P05106 4/20 0.39
ITGA2B P08514 4/20 0.39
EGLN1 Q9GZT9 4/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
PPARG P37231 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
POLB P06746 1/20 0.36
NME4 O00746 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
ADORA2A P29274 1/20 0.36

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
SCHEMBL7363404 0.86 DGAT2 (0.41) CA1CA2CSNK2A2CSNK2BCSNK2A1
SCHEMBL7367816 0.80 PTPRC (0.42) KDM4E
SCHEMBL7372152 0.79 AKT1 (0.32)
SCHEMBL7378240 0.77 CA1 (0.42) CA1CA2CSNK2A2CSNK2BCSNK2A1
Hydrochloric Acid SCHEMBL7366875 0.71 PLAU (0.42) CA1CA2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7379850 0.70 PLAU (0.40) CA1CA2KDM4EPOLB
SCHEMBL7388607 0.70 ABL1 (0.37) EGLN2EGLN1
SCHEMBL7387493 0.70 NAMPT (0.38) POLB
Hydrochloric Acid SCHEMBL7369278 0.69 PLAU (0.36) CA1CA2ITGB3ITGA2BPOLB
SCHEMBL6436503 0.68 CA1 (0.48) CA1CA2CSNK2A2CSNK2BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
EP-1077945-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2001-02-28 EP disclosed
WO-2000005214-A2 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2000-02-03 WO disclosed