SCHEMBL7369764

SCHEMBL7369764

COC(=O)c1ccc(OC)c(NS(=O)(=O)c2ccc3c(NC(N)=NCl)cncc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 5/20 0.52
ALDH1A1 P00352 7/20 0.51
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
ACLY P53396 1/20 0.44
TP53 P04637 2/20 0.41
TSHR P16473 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
POLB P06746 1/20 0.40
LMNA P02545 2/20 0.39
MAPK1 P28482 1/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
Hydrochloric Acid SCHEMBL7370335 0.92 ACLY (0.44) CYP2C9ALDH1A1KMT2AMEN1ACLY
SCHEMBL6434181 0.82 CYP2C9 (0.52) CYP2C9ALDH1A1KMT2AMEN1ACLY
SCHEMBL7049185 0.77 F2 (0.42) ALDH1A1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL7374993 0.77 PLAU (0.42) ALDH1A1KMT2AMEN1KDM4EPOLB
SCHEMBL13425267 0.77 MAPT (0.52) CYP2C9ALDH1A1KMT2AMEN1TP53
SCHEMBL7383159 0.77 PLG (0.55) ALDH1A1KMT2AMEN1ACLYTP53
Hydrochloric Acid SCHEMBL7377310 0.76 PLG (0.54) ALDH1A1KMT2AMEN1ACLYTP53
SCHEMBL7368090 0.75 PLAU (0.51) CYP2C9ALDH1A1KMT2AMEN1KDM4E
SCHEMBL6434188 0.75 CYP2C9 (0.53) CYP2C9ALDH1A1KMT2AMEN1ACLY
SCHEMBL7371811 0.75 PLAU (0.41) KDM4EPOLBLMNAGAA

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