SCHEMBL19075301

SCHEMBL19075301

CCCCCCc1ccc2c(c1)C(C)(C)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.45
▸ KAT8 Q9H7Z6 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ LPL P06858 5/20 0.39
▸ LIPG Q9Y5X9 5/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ HTR2A P28223 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ PPARA Q07869 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ MGLL Q99685 1/20 0.36

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
SCHEMBL13597530 0.91 ALDH1A1 (0.40) GPR3KCNH2STAT3ALDH1A1TRPV1
SCHEMBL17124516 0.90 GPR3 (0.39) GPR3KAT8LPLLIPGHTR2A
SCHEMBL17124517 0.89 GPR3 (0.39) GPR3KAT8LPLLIPGHTR2A
SCHEMBL11887119 0.88 SKP2 (0.41) GPR3LPLLIPGPDK2ALDH1A1
SCHEMBL18537495 0.88 PDK2 (0.39) KCNH2PDK2ALDH1A1
SCHEMBL25866818 0.87 RARB (0.41) GPR3KCNH2LPLLIPGSTAT3
SCHEMBL25866855 0.86 GPR3 (0.39) GPR3KCNH2LPLLIPGSTAT3
SCHEMBL25866833 0.85 HSD11B1 (0.39) GPR3KCNH2STAT3ALDH1A1
SCHEMBL19074898 0.85 LPL (0.41) GPR3KCNH2LPLLIPGHTR2A
SCHEMBL11887112 0.84 PDK2 (0.39) GPR3KCNH2HTR2APDK2ALDH1A1

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-3187522-A1 POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME Sumitomo Chemical Company Limited (JP) 2017-07-05 — — EP disclosed
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