SCHEMBL30974834

SCHEMBL30974834

O=C1CCCCC1n1ccc2c(Cl)ncnc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HCAR1 Q9BXC0 2/20 0.41
▸ PRMT5 O14744 2/20 0.39
▸ WDR77 Q9BQA1 2/20 0.39
▸ SLC22A12 Q96S37 1/20 0.36
▸ SLC18A3 Q16572 1/20 0.35
▸ SRC P12931 3/20 0.34
▸ NNMT P40261 5/20 0.33
▸ FGFR1 P11362 2/20 0.33
▸ FGFR4 P22455 2/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ PIP4K2A P48426 1/20 0.33
▸ MT-CO2 P00403 1/20 0.32
▸ ALOX5 P09917 1/20 0.32

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
SCHEMBL1939828 0.79 PIP4K2A (0.44) PRMT5WDR77SLC22A12SRCNNMT
SCHEMBL30372781 0.78 PIP4K2A (0.39) PRMT5WDR77SLC22A12NNMTFGFR1
SCHEMBL29246916 0.78 PIP4K2A (0.39) PRMT5WDR77SLC22A12NNMTFGFR1
SCHEMBL17877686 0.77 PIP4K2A (0.44) PRMT5WDR77SLC22A12SRCNNMT
SCHEMBL16769943 0.76 SLC22A12 (0.40) PRMT5WDR77SLC22A12NNMTFGFR1
SCHEMBL24753099 0.76 PIP4K2A (0.44) PRMT5WDR77SLC22A12SRCHRH3
SCHEMBL16967987 0.75 PIP4K2A (0.49) PRMT5WDR77SLC22A12SRCFGFR1
SCHEMBL21682107 0.72 PRMT5 (0.39) PRMT5WDR77SLC22A12NNMTFGFR1
SCHEMBL21682109 0.72 PRMT5 (0.39) PRMT5WDR77SLC22A12NNMTFGFR1
SCHEMBL16139203 0.72 CYP2C19 (0.47) PRMT5WDR77SLC22A12

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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