SCHEMBL27469482

SCHEMBL27469482

CCCCCC(CC)(CC)OP(=O)(O)OC(CC)(CC)CCCCC

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.52
FDPS P14324 11/20 0.48
GGPS1 O95749 7/20 0.48
LPAR1 Q92633 3/20 0.46
LPAR3 Q9UBY5 3/20 0.46
LPAR2 Q9HBW0 1/20 0.44

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
SCHEMBL29130564 0.90 SMPD1 (0.58) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL642804 0.88 SMPD1 (0.61) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL28615637 0.86 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL11172321 0.86 SMPD1 (0.59) SMPD1FDPSGGPS1LPAR1LPAR3
Phosphine SCHEMBL22367806 0.86 SMPD1 (0.59) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL25167791 0.86 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL1260436 0.86 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL9224959 0.86 SMPD1 (0.65) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL642803 0.83 SMPD1 (0.46) SMPD1FDPSGGPS1LPAR1LPAR3
SCHEMBL5908869 0.82 SMPD1 (0.59) SMPD1FDPSGGPS1LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110745902-A Method for extracting heavy metals of chromium (VI) and cadmium (II) in water body step by step 西安建筑科技大学 2020-02-04 CN claimed
CN-110745902-B Method for extracting heavy metals of chromium (VI) and cadmium (II) in water body step by step 西安建筑科技大学 2022-03-29 CN disclosed
CN-110745902-A Method for extracting heavy metals of chromium (VI) and cadmium (II) in water body step by step 西安建筑科技大学 2020-02-04 CN disclosed
CN-1163415-C High-purity iron oxide red producing process with iron ore powder and other iron-bearing material 张美焦 2004-08-25 CN disclosed