SCHEMBL3007003

SCHEMBL3007003

O=P(CCO)(CCO)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.68
▸ CFTR P13569 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA4 P22748 1/20 0.48
▸ CA5A P35218 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ ALPG P10696 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ NPY1R P25929 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPY2R P49146 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ TSHR P16473 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ LMNA P02545 1/20 0.43

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
SCHEMBL3007452 0.86 GAA (0.57) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL685639 0.81 GAA (1.00) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL3010717 0.80 GAA (0.54) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL752882 0.79 CFTR (0.78) GAACFTRALDH1A1MEN1KMT2A
Phosphine SCHEMBL27883782 0.77 CFTR (0.75) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL9000804 0.77 NPSR1 (0.56) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL5573059 0.76 ALDH1A1 (0.65) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL1725689 0.76 LMNA (0.61) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL27577740 0.75 GAA (0.60) GAACFTRALDH1A1MEN1KMT2A
SCHEMBL18486441 0.74 TSHR (0.53) GAACFTRALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898738-B1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS STAHL INT B V (NL) 2023-08-23 — — EP disclosed
EP-3898738-A1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS Stahl International B.V. (NL) 2021-10-27 — — EP disclosed
WO-2020130831-A1 PROCESS TO PREPARE HALOGEN-FREE, FLAME-RETARDANT AQUEOUS POLYURETHANE DISPERSIONS STAHL INTERNATIONAL B.V. (NL) 2020-06-25 — — WO disclosed
US-8344096-B2 Phosphorus-containing polycarbonate polyol, method for production thereof, and phosphorus-containing polycarbonate polyurethane UBE INDUSTRIES, LTD. (JP) 2013-01-01 — — US disclosed
US-20100197887-A1 PHOSPHORUS-CONTAINING POLYCARBONATE POLYOL, METHOD FOR PRODUCTION THEREOF, AND PHOSPHORUS-CONTAINING POLYCARBONATE POLYURETHANE UBE INDUSTRIES, LTD. (JP) 2010-08-05 — — US disclosed
EP-0731124-A1 FLAME RETARDANT POLYESTER KANEBO, LTD. (JP) 1996-09-11 — — EP disclosed
US-4007229-A Preparation of hydroxyalkyl phosphine oxides and sulfides BORG-WARNER CORPORATION (US) 1977-02-08 — — US disclosed
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