SCHEMBL18948489

SCHEMBL18948489

O=S(=O)(c1cccc(CNc2cccc(Cl)c2)c1)N1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.63
▸ MEN1 O00255 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ LMNA P02545 4/20 0.55
▸ HTT P42858 3/20 0.55
▸ MAPT P10636 3/20 0.55
▸ NPSR1 Q6W5P4 3/20 0.55
▸ MITF O75030 2/20 0.55
▸ NOD2 Q9HC29 1/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.49
▸ THRB P10828 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ TSHR P16473 1/20 0.48

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
SCHEMBL17479278 0.82 MEN1 (0.54) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL31684032 0.80 ALDH1A1 (0.97) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL4555970 0.80 ALDH1A1 (0.97) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL11936027 0.80 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL15010078 0.79 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL15952845 0.77 LMNA (0.71) ALDH1A1KMT2ALMNAHTTNPSR1
SCHEMBL11229762 0.77 MAPT (0.47) MEN1KMT2AHTTMAPTNPSR1
SCHEMBL1001472 0.76 ALDH1A1 (0.62) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL19308071 0.76 KMT2A (0.45) ALDH1A1MEN1KMT2ALMNANPSR1
SCHEMBL1000605 0.75 ALDH1A1 (0.78) ALDH1A1MEN1KMT2ALMNAMAPT

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-9676747-B2 Hepatitis B antiviral agents NOVIRA THERAPEUTICS, INC. (US) 2017-06-13 — — US disclosed
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