SCHEMBL19851397

SCHEMBL19851397

CC(C)CC(C(=O)Oc1cccc(S(=O)(=O)O)c1)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 4/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ CASR P41180 2/20 0.36
▸ LARS1 Q9P2J5 3/20 0.35
▸ KAT6A Q92794 2/20 0.35
▸ MEP1B Q16820 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CASP6 P55212 1/20 0.33
▸ KDM2B Q8NHM5 1/20 0.33

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
SCHEMBL19851398 0.83 POLB (0.39) CA2CA12CA1CA9TDP1
SCHEMBL25522015 0.80 MEN1 (0.34) L3MBTL1
SCHEMBL19845107 0.80 CASR (0.41) CA2CA12CA1CA9ALDH1A1
SCHEMBL19573301 0.78 ATM (0.50) ALDH1A1TSHRTDP1L3MBTL1
SCHEMBL19851436 0.74 LMNA (0.55) CA2CA12CA1CA9ALDH1A1
SCHEMBL14399304 0.73 ACHE (0.56) ALDH1A1TSHRHSD17B10TDP1MEP1B
SCHEMBL21291493 0.71 ELANE (0.42) CA2CA12CA1CA9TSHR
SCHEMBL25522011 0.71 LMNA (0.47) ALDH1A1L3MBTL1
SCHEMBL11111214 0.71 TSHR (0.49) CA2CA12CA1CA9ALDH1A1
SCHEMBL28329320 0.71 GCK (0.40) ALDH1A1KAT6A

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-20180036689-A1 FUNCTIONAL POLYMER MEMBRANE, METHOD FOR MANUFACTURING SAME, COMPOSITION FOR FORMING FUNCTIONAL POLYMER MEMBRANE, SEPARATION MEMBRANE MODULE, AND ION-EXCHANGE DEVICE FUJIFILM CORPORATION (JP) 2018-02-08 — — US disclosed
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