SCHEMBL29065780

SCHEMBL29065780

COC(=O)CCc1sccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 4/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90B1 P14625 1/20 0.39
TKT P29401 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL13225707 0.84 NPC1 (0.42) KAT2BMAPTKMT2AALDH1A1LMNA
SCHEMBL27615571 0.82 SLC6A3 (0.39) MAPTKMT2AALDH1A1LMNAHTT
SCHEMBL27581981 0.81 KMT2A (0.43) KAT2BMAPTKMT2AALDH1A1LMNA
SCHEMBL25341019 0.79 LTB4R (0.42) MAPTKMT2AALDH1A1LMNAHTT
SCHEMBL23330285 0.78 KMT2A (0.45) KAT2BMAPTKMT2AALDH1A1LMNA
SCHEMBL7025095 0.76 UTRN (0.33) KMT2AMEN1HSP90AA1HSP90B1
SCHEMBL20562605 0.76 KMT2A (0.56) MAPTKMT2AALDH1A1LMNAHTT
SCHEMBL10504995 0.75 LTB4R (0.41) MAPTKMT2AALDH1A1LMNAHTT
SCHEMBL20504803 0.74 KMT2A (0.42) MAPTKMT2AALDH1A1LMNAHTT
SCHEMBL27344560 0.74 ALDH1A1 (0.44) MAPTKMT2AALDH1A1LMNAHSD17B10

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-114477223-B Preparation method and application of sulfhydryl-functionalized SBA molecular sieve 中国石油化工股份有限公司 2023-09-08 CN claimed
CN-114477223-B Preparation method and application of sulfhydryl-functionalized SBA molecular sieve 中国石油化工股份有限公司 2023-09-08 CN disclosed