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Sugi Predict / Compounds / SCHEMBL7651857

SCHEMBL7651857

SCHEMBL7651857

O=S(=O)(c1ccc(Br)cc1)N1CCN(CC2CCN(c3ccncc3F)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 3/20 0.50
▸ ALDH1A1 P00352 6/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TSHR P16473 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PKM P14618 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ TPSAB1 Q15661 1/20 0.41

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
SCHEMBL7662786 0.90 LSS (0.53) LSSALDH1A1L3MBTL1PKMTPSAB1
SCHEMBL7442077 0.84 LSS (0.73) LSSALDH1A1SMN1; SMN2L3MBTL1PKM
SCHEMBL7653537 0.84 LSS (0.66) LSSALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL7662833 0.75 TP53 (0.62) LSSLMNAL3MBTL1
SCHEMBL8112377 0.74 TPSAB1 (0.61) LSSGAATPSAB1
SCHEMBL7660042 0.74 LSS (0.77) LSSALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7660934 0.72 LSS (0.48) LSSALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL7657257 0.72 LSS (0.52) LSSALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL7449226 0.72 LSS (0.59) LSSSMN1; SMN2L3MBTL1GAA
SCHEMBL22032750 0.71 MEN1 (0.60) ALDH1A1SMN1; SMN2LMNA

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-6335341-B1 ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS ZENECA LIMITED (GB) 2002-01-01 — — US disclosed