SCHEMBL29022575

SCHEMBL29022575

O=S(=O)(NCCCN1CCC(CCCc2ccccc2)CC1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 3/20 0.57
▸ ALDH1A1 P00352 2/20 0.51
▸ KCNH2 Q12809 3/20 0.49
▸ HRH3 Q9Y5N1 3/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ SLC6A4 P31645 1/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ NMT1 P30419 2/20 0.48
▸ MAPT P10636 1/20 0.47
▸ MBTD1 Q05BQ5 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ CARM1 Q86X55 1/20 0.47
▸ PRMT6 Q96LA8 1/20 0.47
▸ CCR3 P51677 1/20 0.47

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
SCHEMBL25758620 0.97 HTR7 (0.53) HTR7ALDH1A1KCNH2HRH3SLC6A2
SCHEMBL30375512 0.94 TAAR1 (0.53) HTR7ALDH1A1SLC6A4HTR2ACCR3
SCHEMBL24069429 0.88 SLC6A2 (0.63) HTR7KCNH2SLC6A2SLC6A4MEN1
SCHEMBL29022586 0.88 HTR7 (0.69) HTR7ALDH1A1KCNH2HTR2ATP53
SCHEMBL30389889 0.86 HTR7 (0.48) HTR7KCNH2HRH3HTR2A
SCHEMBL25290527 0.85 SLC6A2 (0.59) HTR7KCNH2SLC6A2SLC6A4MEN1
SCHEMBL25758613 0.84 HTR7 (0.64) HTR7ALDH1A1KCNH2SLC6A4HTR2A
SCHEMBL25758526 0.82 CCR3 (0.58) HTR7SLC6A2SLC6A4MEN1HTT
SCHEMBL25758544 0.82 MEN1 (0.69) HTR7KCNH2SLC6A2SLC6A4HTR2A
SCHEMBL25758537 0.82 HTR7 (0.58) HTR7ALDH1A1SLC6A2SLC6A4TP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116157124-A Sulfonamide derivative and pharmaceutical composition for preventing or treating mental diseases containing the same as active ingredient 大邱庆北尖端医疗产业振兴财团 2023-05-23 — — CN claimed
CN-116157124-A Sulfonamide derivative and pharmaceutical composition for preventing or treating mental diseases containing the same as active ingredient 大邱庆北尖端医疗产业振兴财团 2023-05-23 — — CN disclosed
EP-4159718-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS Daegu-Gyeongbuk Medical Innovation Foundation (KR) 2023-04-05 — — EP disclosed
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