SCHEMBL29068453

SCHEMBL29068453

CCCC(CC)C(C(CC)CCC)C(C)OP(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.42
METAP1 P53582 2/20 0.41
FDPS P14324 3/20 0.38
PTPN1 P18031 1/20 0.34
LMNA P02545 1/20 0.31

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
SCHEMBL29068417 0.92 SMPD1 (0.44) SMPD1METAP1FDPSPTPN1
SCHEMBL29068439 0.90 SMPD1 (0.39) SMPD1METAP1FDPSPTPN1
SCHEMBL29068419 0.86 SMPD1 (0.47) SMPD1METAP1FDPSPTPN1
SCHEMBL29068438 0.82 METAP1 (0.48) SMPD1METAP1FDPSPTPN1
SCHEMBL29068422 0.79 SMPD1 (0.46) SMPD1METAP1FDPSPTPN1LMNA
SCHEMBL29068473 0.78 SMPD1 (0.39) SMPD1METAP1FDPSPTPN1
SCHEMBL28174512 0.78 SMPD1 (0.50) SMPD1METAP1FDPSPTPN1
SCHEMBL29068456 0.76 SMPD1 (0.52) SMPD1METAP1FDPSPTPN1
SCHEMBL5963330 0.75 METAP1 (0.48) SMPD1METAP1FDPSPTPN1
SCHEMBL29068395 0.74 SMPD1 (0.59) SMPD1FDPSPTPN1

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-116745025-A membrane for water filtration 水通道蛋白有限公司 2023-09-12 CN disclosed