SCHEMBL8551861

SCHEMBL8551861

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 3/20 0.38
PTGES O14684 1/20 0.37
ALDH1A1 P00352 2/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HAT1 O14929 1/20 0.36
EP300 Q09472 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
BRD4 O60885 1/20 0.35
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
HCRTR1 O43613 1/20 0.33
CASP6 P55212 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
SCHEMBL251645 0.89 ALOX5 (0.43) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8554263 0.88 ALOX5 (0.39) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8551585 0.87 SMN1; SMN2 (0.48) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL7707823 0.80 ALOX5 (0.44) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8553605 0.78 ALOX5 (0.48) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL6930961 0.78 ALOX5 (0.39) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8555588 0.78 SMN1; SMN2 (0.47) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8554409 0.77 LMNA (0.47) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL7424550 0.77 ALOX5 (0.39) ALOX5PDE3BPDE3ASMN1; SMN2LMNA
SCHEMBL8558633 0.73 ALOX5 (0.40) ALOX5PDE3BPDE3ASMN1; SMN2LMNA

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-0839030-A2 BIS- HYDRAZONES] ALTEON, INC. (US) 1998-05-06 EP disclosed
WO-1996021450-A2 BIS-[HYDRAZONES] ALTEON INC. (US) 1996-07-18 WO disclosed