Nonane

Nonane

SCHEMBL11301883

CCCCCCCCC.N.N.O=P(O)(O)O

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Nonane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 6/20 0.65
▸ LPAR2 Q9HBW0 3/20 0.65
▸ FDPS P14324 11/20 0.56
▸ GGPS1 O95749 6/20 0.56
▸ LPAR1 Q92633 2/20 0.56
▸ TSHR P16473 1/20 0.53
▸ THRB P10828 1/20 0.53

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
Dodecane SCHEMBL1262800 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL4445679 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Phosphoric Acid SCHEMBL11131007 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Decane SCHEMBL11045607 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Dodecane SCHEMBL6284055 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL3458550 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Pentadecane SCHEMBL10884902 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Nonane SCHEMBL11359995 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Octane SCHEMBL21854612 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1
Hexadecane SCHEMBL6866668 0.97 LPAR3 (0.68) LPAR3LPAR2FDPSGGPS1LPAR1

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
EP-0055863-A2 Catalyst, method for making and use of same for polymerizing olefins PHILLIPS PETROLEUM COMPANY (US) 1982-07-14 — — EP disclosed
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