SCHEMBL29157657

SCHEMBL29157657

CN([C@H]1CCN(c2ccc(Cl)cc2)C1)S(C)(=O)=O

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 2/20 0.55
▸ NPY5R Q15761 6/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ CYP3A4 P08684 1/20 0.50
▸ HTR2A P28223 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ NOTUM Q6P988 1/20 0.48
▸ MCHR1 Q99705 2/20 0.47
▸ GPR119 Q8TDV5 2/20 0.43
▸ PDE10A Q9Y233 1/20 0.41
▸ PIK3CD O00329 2/20 0.40
▸ PIK3R1 P27986 2/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ PIK3CB P42338 2/20 0.40
▸ F10 P00742 1/20 0.40

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
SCHEMBL29157650 1.00 LSS (0.55) LSSNPY5RMEN1KMT2ACYP3A4
SCHEMBL29157649 1.00 LSS (0.55) LSSNPY5RMEN1KMT2ACYP3A4
SCHEMBL24680782 0.82 NPY5R (0.48) LSSNPY5RMEN1KMT2AL3MBTL1
SCHEMBL29914459 0.82 NPY5R (0.48) LSSNPY5RMEN1KMT2AL3MBTL1
SCHEMBL24681150 0.82 MCHR1 (0.59) LSSNPY5RMEN1KMT2ANOTUM
SCHEMBL13723675 0.78 LSS (0.46) LSSNPY5RMEN1KMT2ACYP3A4
SCHEMBL24681617 0.77 CA1 (0.40) LSSNPY5RCYP3A4PDE10APIK3CD
SCHEMBL24681524 0.77 CA1 (0.40) LSSNPY5RCYP3A4PDE10APIK3CD
SCHEMBL29914405 0.77 CA1 (0.40) LSSNPY5RCYP3A4PDE10APIK3CD
SCHEMBL29914498 0.77 ACVR1 (0.41) NPY5RCYP3A4GPR119PDE10APIK3CD

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-117597340-A Substituted amino-aza-heteroaryl compounds as inhibitors of hematopoietic progenitor kinase 1 (HPK 1) 安大略省癌症研究所(OICR) 2024-02-23 — — CN disclosed
WO-2022226667-A1 SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
WO-2022226666-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
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