SCHEMBL22474334

SCHEMBL22474334

CCC(=O)OC(C)C(OCC1CC1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR88 Q9GZN0 3/20 0.40
▸ PTGIR P43119 6/20 0.39
▸ POLB P06746 1/20 0.38
▸ PDE4B Q07343 1/20 0.37
▸ BCHE P06276 1/20 0.35
▸ ACHE P22303 1/20 0.35

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
SCHEMBL17900617 0.84 PTGIR (0.40) GPR88PTGIRBCHEACHE
SCHEMBL22474221 0.80 TSHR (0.39) GPR88
SCHEMBL22474225 0.80 TSHR (0.39) GPR88
SCHEMBL22474226 0.80 LMNA (0.39) GPR88POLB
SCHEMBL22474203 0.78 CYP3A4 (0.47) —
SCHEMBL17900550 0.78 GPR88 (0.38) GPR88PTGIRBCHEACHE
SCHEMBL17900647 0.76 KMT2A (0.44) GPR88
SCHEMBL17900762 0.76 KMT2A (0.44) GPR88
SCHEMBL22474290 0.76 MTNR1A (0.42) —
SCHEMBL17900766 0.75 FFAR1 (0.39) GPR88PTGIR

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-3255991-B1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2020-09-30 — — EP disclosed
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