SCHEMBL30974668

SCHEMBL30974668

COC(=O)C1(OS(C)(=O)=O)CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.50
MAPT P10636 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
CYP3A4 P08684 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL2481437 0.90 NPSR1 (0.45) NPSR1CYP4F2CYP4A11CYP3A4TSHR
SCHEMBL6136955 0.82 NPSR1 (0.34) NPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL17869535 0.80 NPSR1 (0.35) NPSR1
SCHEMBL14809324 0.78 NPSR1 (0.36) NPSR1
SCHEMBL25973904 0.77 NPSR1 (0.48) NPSR1MAPTCYP4F2CYP4A11CYP3A4
SCHEMBL29246996 0.76 NPSR1 (0.36) NPSR1
SCHEMBL2775123 0.74 NPSR1 (0.50) NPSR1MAPTCYP4F2CYP4A11CYP3A4
SCHEMBL19359199 0.74 NPSR1 (0.32) NPSR1TSHR
SCHEMBL3375373 0.72 NPSR1 (0.44) NPSR1CYP4F2CYP4A11CYP3A4ALDH1A1
SCHEMBL16234619 0.71 CYP3A4 (0.42) NPSR1MAPTCYP4F2CYP4A11CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118317963-A TRPML modulators, compositions thereof, and methods of use 卡拉韦治疗公司 2024-07-09 CN disclosed