SCHEMBL11295413

SCHEMBL11295413

CCCCCC(O)[C@@]1(O)C(O)C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 7/20 0.35
▸ SPHK1 Q9NYA1 2/20 0.35
▸ FFAR1 O14842 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ CYP2D6 P10635 2/20 0.33
▸ GMNN O75496 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CETP P11597 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ UBE2N P61088 1/20 0.33
▸ GBA1 P04062 2/20 0.33

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
SCHEMBL11295412 1.00 GPR84 (0.35) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL10003384 0.65 — —
SCHEMBL30787458 0.63 GPR84 (0.54) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL996439 0.63 — —
SCHEMBL30787358 0.62 FFAR1 (0.62) GPR84SPHK1FFAR1LMNA
SCHEMBL327431 0.62 FFAR1 (0.62) GPR84SPHK1FFAR1LMNA
SCHEMBL8467380 0.62 GPR84 (0.50) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL1697125 0.62 GPR84 (0.50) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL1295728 0.62 SPHK1 (0.64) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL26481 0.62 — —

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-4322557-A 1-Aryloxy-2-(S)-hydroxy-3-(triarylphosphonio)-propane derivatives as prostaglandin intermediates PFIZER INC. (US) 1982-03-30 — — US disclosed
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