SCHEMBL7981183

SCHEMBL7981183

COC(=O)c1c(C(=O)O)ccc2sc3ccccc3c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 5/20 0.47
TDP1 Q9NUW8 3/20 0.47
ATM Q13315 2/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 2/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
NPC1 O15118 2/20 0.45
PRNP P04156 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL27496885 0.89 LMNA (0.51) LMNAMAPK1L3MBTL1TDP1ATM
SCHEMBL87423 0.85 PRNP (0.48) LMNAMAPK1TDP1MEN1KMT2A
SCHEMBL9811801 0.75 MAOB (0.50) LMNAMAPK1L3MBTL1TDP1MEN1
SCHEMBL7985137 0.75 WDR5 (0.51) LMNAMAPK1TDP1MEN1KMT2A
SCHEMBL25904738 0.75 LMNA (0.82) LMNAMAPK1L3MBTL1TDP1ATM
SCHEMBL19758774 0.75 IKBKB (0.46) LMNAMAPK1TDP1ATMMEN1
SCHEMBL29450544 0.74 PRNP (0.51) MAPK1TDP1MEN1KMT2AALDH1A1
SCHEMBL4587587 0.74 PRNP (0.51) MAPK1TDP1MEN1KMT2AALDH1A1
SCHEMBL30536707 0.74 MEN1 (0.42) TDP1MEN1KMT2AALDH1A1MAPT
SCHEMBL1667159 0.73 NCEH1 (0.56) LMNAMAPK1TDP1MEN1KMT2A

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
US-6300340-B1 USEFUL FOR THERAPY OF CANCER AND SOLID TUMORS ADIR ET COMPAGNIE (FR) 2001-10-09 US disclosed
US-6162822-A Bisimide compounds ADIR ET COMPAGNIE (FR) 2000-12-19 US disclosed
US-5854273-A Bisimide compounds ADIR ET COMPAGNIE (FR) 1998-12-29 US disclosed
CN-1182086-A New bisimide compounds, process for preparing them and pharmaceutical compositions containing them ADIR (FR) 1998-05-20 CN disclosed