SCHEMBL9809082

SCHEMBL9809082

Cc1c(SC(Cl)(Cl)Cl)c(=O)n(-c2ccccc2)n1C

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.54
ALDH1A1 P00352 2/20 0.54
BCHE P06276 1/20 0.54
PTGS2 P35354 1/20 0.54
LMNA P02545 2/20 0.53
ADORA3 P0DMS8 1/20 0.53
TSHR P16473 3/20 0.51
CYP1A2 P05177 2/20 0.51
NAPRT Q6XQN6 2/20 0.51
THRB P10828 1/20 0.51
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 2/20 0.48
CYP2D6 P10635 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 3/20 0.46

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
SCHEMBL9809077 0.85 ALOX15 (0.54) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809065 0.82 ALOX15 (0.62) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809069 0.80 ALOX15 (0.58) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL9809087 0.76 ALOX15 (0.58) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL3882745 0.76 CYP19A1 (0.56) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL536896 0.75 CYP19A1 (0.55) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL29993 0.74 ALDH1A1 (0.64) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL2449608 0.73 ALOX15 (0.68) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL588715 0.73 ALDH1A1 (0.68) ALOX15ALDH1A1BCHEPTGS2LMNA
SCHEMBL11313942 0.72 LMNA (0.81) ALDH1A1BCHEPTGS2LMNAADORA3

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