SCHEMBL29451981

SCHEMBL29451981

Cc1c(F)cc(N)cc1S(=O)(=O)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ ALOX5AP P20292 4/20 0.37
▸ FEN1 P39748 4/20 0.37
▸ TSHR P16473 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GLA P06280 1/20 0.35
▸ PDE2A O00408 1/20 0.35
▸ PDE5A O76074 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ PDE1B Q01064 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ PDE4B Q07343 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ PDE7A Q13946 1/20 0.35
▸ PDE1C Q14123 1/20 0.35

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
SCHEMBL31195184 0.76 ALDH1A1 (0.43) ALDH1A1ALOX5APFEN1PDE2APDE5A
SCHEMBL29451494 0.73 ALDH1A1 (0.59) ALDH1A1TSHRPDE2APDE5ACYP3A4
SCHEMBL12352542 0.71 ALDH1A1 (0.47) ALDH1A1TSHRMAPTCYP3A4MEN1
SCHEMBL7537342 0.70 ALDH1A1 (0.56) ALDH1A1PDE2APDE5ACYP3A4ALOX15
SCHEMBL29451752 0.70 ALDH1A1 (0.56) ALDH1A1PDE2APDE5ACYP3A4ALOX15
SCHEMBL2663819 0.69 ALDH1A1 (0.41) ALDH1A1ALOX5APFEN1TSHRMAPT
SCHEMBL16364899 0.68 ALDH1A1 (0.55) ALDH1A1TSHRPDE2APDE5ACYP3A4
SCHEMBL9646971 0.67 ALDH1A1 (0.41) ALDH1A1ALOX5APFEN1TSHRMAPT
SCHEMBL11394393 0.67 ALDH1A1 (0.41) ALDH1A1ALOX5APFEN1TSHRMAPT
SCHEMBL4639725 0.67 L3MBTL1 (0.63) ALDH1A1ALOX5APFEN1TSHRMAPT

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
WO-2022032144-A1 SUBSTRATE ADAPTOR INHIBITORS OF PRMT5 AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2022-02-10 — — WO disclosed
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