SCHEMBL22345561

SCHEMBL22345561

CCCCO[PH](=O)C(CC)CCC

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 1/20 0.30

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
SCHEMBL2511230 0.92 CYP3A4 (0.33) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL29120197 0.88
SCHEMBL1726219 0.83 FDPS (0.35) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL29120183 0.81 CHRM1 (0.31)
SCHEMBL29131119 0.76
SCHEMBL30827414 0.75 CYP3A4 (0.33) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL29120194 0.74
SCHEMBL29240387 0.73 CYP3A4 (0.32) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL31555688 0.73 CYP3A4 (0.32) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL9161298 0.71 CYP3A4 (0.33) CYP3A4ALDH1A1ADRB2ADRB1ADRB3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220195147-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS CLARIANT INTERNATIONAL LTD (CH) 2022-06-23 US claimed
EP-3924411-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS Clariant International Ltd. (CH) 2021-12-22 EP claimed
WO-2020165017-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS CLARIANT PLASTICS & COATINGS LTD (CH) 2020-08-20 WO claimed
US-20220195147-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS CLARIANT INTERNATIONAL LTD (CH) 2022-06-23 US disclosed
EP-3924411-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS Clariant International Ltd. (CH) 2021-12-22 EP disclosed
WO-2020165017-A1 FLAME RETARDANT MIXTURE FOR THERMOPLASTIC POLYMERS CLARIANT PLASTICS & COATINGS LTD (CH) 2020-08-20 WO disclosed