SCHEMBL29247166

SCHEMBL29247166

CC(C)(C)OC(=O)[C@H]1CCC[C@@H](n2ccc3c(Cl)ncnc32)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.38
▸ ACACB O00763 1/20 0.37
▸ NNMT P40261 9/20 0.35
▸ PIP4K2A P48426 1/20 0.35
▸ SLC22A12 Q96S37 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PIK3CD O00329 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ HCK P08631 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ EPHB4 P54760 1/20 0.33
▸ PRKDC P78527 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33

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
SCHEMBL30974881 1.00 GPR119 (0.38) GPR119ACACBNNMTPIP4K2ASLC22A12
SCHEMBL29247169 1.00 GPR119 (0.38) GPR119ACACBNNMTPIP4K2ASLC22A12
SCHEMBL30372589 0.84 SLC22A12 (0.39) ACACBNNMTPIP4K2ASLC22A12PRMT5
SCHEMBL29247142 0.84 SLC22A12 (0.39) ACACBNNMTPIP4K2ASLC22A12PRMT5
SCHEMBL29247145 0.84 SLC22A12 (0.39) ACACBNNMTPIP4K2ASLC22A12PRMT5
SCHEMBL30373136 0.83 NNMT (0.41) ACACBNNMTSLC22A12PRMT5WDR77
SCHEMBL29247562 0.83 NNMT (0.41) ACACBNNMTSLC22A12PRMT5WDR77
SCHEMBL25047944 0.82 PIP4K2A (0.44) ACACBNNMTPIP4K2ASLC22A12KMT2A
SCHEMBL12395349 0.79 GPR119 (0.46) GPR119PIP4K2AUBA6
SCHEMBL13861581 0.79 SRC (0.48) GPR119PIK3CDABL1EGFRSRC

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
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