SCHEMBL9809065

SCHEMBL9809065

Cc1c(SSc2c(C)n(C)n(-c3ccccc3)c2=O)c(=O)n(-c2ccccc2)n1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.62
ALDH1A1 P00352 2/20 0.62
BCHE P06276 1/20 0.62
PTGS2 P35354 1/20 0.62
LMNA P02545 3/20 0.60
ADORA3 P0DMS8 1/20 0.60
TSHR P16473 3/20 0.58
CYP1A2 P05177 2/20 0.58
THRB P10828 2/20 0.58
NAPRT Q6XQN6 1/20 0.58
KMT2A Q03164 4/20 0.55
KDM4E B2RXH2 3/20 0.54
CYP2D6 P10635 1/20 0.54
POLB P06746 1/20 0.53
MAPT P10636 4/20 0.50
MEN1 O00255 2/20 0.50
TP53 P04637 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
MAPK1 P28482 1/20 0.50

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
SCHEMBL9809069 0.86 ALOX15 (0.58) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809075 0.83 BCHE (0.47) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809077 0.82 ALOX15 (0.54) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809087 0.82 ALOX15 (0.58) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809082 0.82 ALOX15 (0.54) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL3882745 0.82 CYP19A1 (0.56) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL536896 0.81 CYP19A1 (0.55) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL588715 0.79 ALDH1A1 (0.68) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL2449608 0.79 ALOX15 (0.68) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809118 0.78 POLB (0.42) ALOX15ALDH1A1BCHEPTGS2LMNA

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
US-5063245-A Hormone inhibitors NOVA PHARMACEUTICAL CORPORATION (US) 1991-11-05 US disclosed