SCHEMBL29956375

SCHEMBL29956375

O=S(=O)(c1cccc(B(O)O)c1)N1CCCCC1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
LMNA P02545 4/20 0.62
TSHR P16473 3/20 0.62
NPSR1 Q6W5P4 2/20 0.62
THRB P10828 1/20 0.62
HTT P42858 1/20 0.60
GAA P10253 1/20 0.60
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPT P10636 1/20 0.59
IL1RN P18510 1/20 0.59
USP2 O75604 1/20 0.55
MCOLN3 Q8TDD5 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL3915596 1.00 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL519915 0.98 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL12538126 0.84 TSHR (0.60) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL29664081 0.84 TSHR (0.60) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL21813105 0.84 POLB (0.61) SMN1; SMN2LMNATSHRHTTGAA
SCHEMBL1742543 0.81 USP2 (0.71) ALDH1A1SMN1; SMN2LMNAHTTGAA
SCHEMBL12674581 0.80 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL4555427 0.80 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL28308929 0.80 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL31684030 0.80 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2LMNATSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063495-A Preparation method of 3- (piperidine-1-ylsulfonyl) phenylboronic acid 甘肃瀚科药业有限公司 2024-05-24 CN claimed
WO-2025104079-A1 SALICYLIC ACID AND PICOLINIC ACID DERIVATIVES AS INHIBITORS OF ENERGY COUPLING FACTOR (ECF) TRANSPORTERS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2025-05-22 WO disclosed
CN-118339145-A Bicyclic fused ring derivatives or salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-12 CN disclosed
CN-118063495-A Preparation method of 3- (piperidine-1-ylsulfonyl) phenylboronic acid 甘肃瀚科药业有限公司 2024-05-24 CN disclosed
CN-118063495-A Preparation method of 3- (piperidine-1-ylsulfonyl) phenylboronic acid 甘肃瀚科药业有限公司 2024-05-24 CN disclosed
CN-118063495-A Preparation method of 3- (piperidine-1-ylsulfonyl) phenylboronic acid 甘肃瀚科药业有限公司 2024-05-24 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed