SCHEMBL25819149

SCHEMBL25819149

CC(C)c1ccc(Oc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.58
▸ ALDH1A1 P00352 6/20 0.58
▸ MAPT P10636 4/20 0.58
▸ GAA P10253 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ SMN1; SMN2 Q16637 8/20 0.55
▸ HTT P42858 7/20 0.55
▸ PKM P14618 4/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ POLB P06746 4/20 0.46
▸ MMP2 P08253 1/20 0.45
▸ MMP3 P08254 1/20 0.45
▸ MMP9 P14780 1/20 0.45
▸ MMP8 P22894 1/20 0.45
▸ MMP13 P45452 1/20 0.45
▸ MMP14 P50281 1/20 0.45
▸ CNR2 P34972 1/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43

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
SCHEMBL10000942 1.00 LMNA (0.58) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL25819157 0.94 LMNA (0.53) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL12642923 0.93 SMN1; SMN2 (0.67) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL27048202 0.93 PKM (0.66) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL16638686 0.93 SMN1; SMN2 (0.67) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL20661662 0.91 PKM (0.59) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL10066695 0.91 LMNA (0.50) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL18661789 0.88 ALDH1A1 (0.47) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL20171939 0.88 PKM (0.59) LMNAALDH1A1MAPTGAAKDM4E
SCHEMBL10030394 0.88 MAPT (0.47) LMNAALDH1A1MAPTGAAKDM4E

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-20230220158-A1 IONOMERS WITH MACROCYCLIC MOIETIES FOR ION CONDUCTIVITY AND PERMSELECTIVITY NATIONAL SCIENCE FOUNDATION 2023-07-13 — — US disclosed
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