SCHEMBL30949337

SCHEMBL30949337

O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2)cc1)NCc1ccc(Br)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SGMS1 Q86VZ5 11/20 1.00
TBXA2R P21731 1/20 0.64
TBXAS1 P24557 1/20 0.64
ALDH1A1 P00352 2/20 0.61
POLB P06746 1/20 0.59
HTT P42858 1/20 0.58

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
SCHEMBL9512082 0.81 TBXA2R (0.76) SGMS1TBXA2RTBXAS1ALDH1A1POLB
SCHEMBL13401889 0.80 KMT2A (0.67) SGMS1ALDH1A1POLB
SCHEMBL13401884 0.80 ALDH1A1 (0.79) SGMS1ALDH1A1
SCHEMBL9129394 0.80 SGMS1 (0.74) SGMS1ALDH1A1HTT
SCHEMBL3915476 0.79 PRMT1 (0.71) SGMS1ALDH1A1POLB
SCHEMBL23294744 0.79 TBXA2R (0.73) SGMS1TBXA2RTBXAS1ALDH1A1POLB
Sulotroban SCHEMBL34187 0.78 TBXA2R (1.00) SGMS1TBXA2RTBXAS1ALDH1A1POLB
SCHEMBL15145811 0.78 POLB (0.74) SGMS1ALDH1A1POLBHTT
SCHEMBL9128396 0.78 SGMS1 (0.91) SGMS1TBXA2RTBXAS1ALDH1A1HTT
Sulotroban SCHEMBL9585833 0.78 TBXA2R (0.79) SGMS1TBXA2RTBXAS1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118161616-A Use of SMS1 and sphingomyelin synthetic pathway as therapeutic target for fever with thrombocytopenia syndrome 中国人民解放军军事科学院军事医学研究院 2024-06-11 CN claimed
WO-2026100539-A1 PHARMACEUTICAL COMPOSITION FOR PROMOTING MIGRATION OF SUBSTANCE TO CENTRAL NERVOUS SYSTEM 小野薬品工業株式会社 2026-05-15 WO disclosed