SCHEMBL28416747

SCHEMBL28416747

O=S(=O)(O)C1CCN(Cc2ccccn2)C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ KDM4E B2RXH2 5/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ LMNA P02545 1/20 0.51
▸ SIGMAR1 Q99720 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ POLB P06746 2/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ DRD4 P21917 1/20 0.46
▸ PKM P14618 1/20 0.45

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
SCHEMBL6397064 0.79 L3MBTL1 (0.59) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL20635766 0.77 KMT2A (0.50) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL938062 0.77 L3MBTL1 (0.57) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL31653494 0.77 L3MBTL1 (0.57) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL21061969 0.77 L3MBTL1 (0.82) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL21061629 0.77 L3MBTL1 (0.82) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL14197754 0.76 LMNA (0.60) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL6397656 0.76 L3MBTL1 (0.56) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL6399073 0.76 L3MBTL1 (0.56) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1
SCHEMBL2033541 0.76 L3MBTL1 (0.56) L3MBTL1KDM4ESMN1; SMN2LMNASIGMAR1

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-111333625-B Phenyl pyrrolidine compounds and uses thereof 武汉人福创新药物研发中心有限公司 2022-10-18 — — CN disclosed
CN-111333625-A Phenyl pyrrolidine compounds and uses thereof 湖北生物医药产业技术研究院有限公司 2020-06-26 — — CN disclosed
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