SCHEMBL9484274

SCHEMBL9484274

CCC1CCC(OP(=O)(O)OC2CCC(CC)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.37
INPP5A Q14642 1/20 0.34
ACHE P22303 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
SCHEMBL24710207 0.86 CYP19A1 (0.36) CYP19A1INPP5AACHE
SCHEMBL9485332 0.84 ALDH1A1 (0.36) INPP5A
SCHEMBL5850409 0.82 INPP5A (0.44) INPP5AACHE
SCHEMBL9485449 0.78 S1PR1 (0.43)
SCHEMBL9485299 0.78 S1PR1 (0.43)
SCHEMBL27332982 0.76 CYP19A1 (0.33) CYP19A1
SCHEMBL9484912 0.76 INPP5A (0.38) CYP19A1INPP5AACHE
SCHEMBL9484731 0.75 INPP5A (0.39) INPP5A
SCHEMBL23823353 0.73 ACHE (0.41) INPP5AACHE
SCHEMBL5850657 0.72 ACHE (0.41) INPP5AACHE

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
US-5258167-A Extractant for rare earth metal and method for extracting the same LION CORPORATION (JP) 1993-11-02 US disclosed