SCHEMBL8555972

SCHEMBL8555972

CCCc1[nH]c2cc(NC(=O)OC(C)(C)C)cc(Cc3ccccc3Cl)c2c1C(=O)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
CTSK P43235 2/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
PPARG P37231 1/20 0.34
PTGES O14684 1/20 0.33
TACR1 P25103 2/20 0.33
TOP2A P11388 1/20 0.32
TOP2B Q02880 1/20 0.32
DGAT1 O75907 1/20 0.32
KCNJ6 P48051 1/20 0.32
KCNJ5 P48544 1/20 0.32
KCNJ3 P48549 1/20 0.32
NR1I3 Q14994 1/20 0.32
JAK2 O60674 1/20 0.31

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
SCHEMBL8556676 0.83 ALOX5 (0.38) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL8558633 0.80 ALOX5 (0.40) ALOX5LMNASMN1; SMN2PDE3BPDE3A
Hydrochloric Acid SCHEMBL8627726 0.80 ALOX5 (0.40) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL6930961 0.79 ALOX5 (0.39) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL7421254 0.71 PTGES (0.41) SMN1; SMN2PPARGPTGESNR1I3
SCHEMBL8551585 0.70 SMN1; SMN2 (0.48) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL251645 0.70 ALOX5 (0.43) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL8555588 0.69 SMN1; SMN2 (0.47) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL8554409 0.69 LMNA (0.47) ALOX5LMNASMN1; SMN2PDE3BPDE3A
SCHEMBL8554263 0.67 ALOX5 (0.39) ALOX5LMNASMN1; SMN2PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed