SCHEMBL29328239

SCHEMBL29328239

CCC(C)(C)C(=O)OCC(O)COc1ccc2c(c1)OCO2

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.57
▸ POLB P06746 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ RAB9A P51151 3/20 0.48
▸ ADRB2 P07550 4/20 0.47
▸ ADRB1 P08588 4/20 0.47
▸ ADRB3 P13945 4/20 0.47
▸ PRMT5 O14744 1/20 0.45
▸ WDR77 Q9BQA1 1/20 0.45
▸ FKBP1A P62942 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ NPC1 O15118 2/20 0.42

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
SCHEMBL29328245 0.83 MAPT (0.38) MAPTPOLBMEN1KMT2AADRB2
SCHEMBL29328236 0.81 MAPT (0.59) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL10064132 0.79 KMT2A (0.51) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL29403088 0.79 MAPT (0.71) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL29403611 0.78 MAPT (0.63) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL29403475 0.78 MAPT (0.63) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL29400896 0.76 MAPT (0.72) MAPTPOLBMEN1KMT2ARAB9A
SCHEMBL12889011 0.76 CYP2D6 (0.51) MAPTPOLBMEN1KMT2AADRB2
SCHEMBL12359278 0.76 CA12 (0.53) MAPTPOLBRAB9AADRB2ADRB1
SCHEMBL13296212 0.75 ALDH1A1 (0.47) MAPTKMT2AALDH1A1GAALMNA

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-12044968-B2 Protective film-forming composition having acetal structure and amide structure NISSAN CHEMICAL CORPORATION (JP) 2024-07-23 — — US disclosed
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