SCHEMBL8673563

SCHEMBL8673563

CC(C)(O)C(=O)c1ccccc1OCCOCC1CO1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.48
▸ LMNA P02545 4/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ KMT2A Q03164 4/20 0.46
▸ PTK2B Q14289 1/20 0.46
▸ GLA P06280 1/20 0.43
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ THRB P10828 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ CHRM2 P08172 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
SCHEMBL1410038 0.89 ALDH1A1 (0.55) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL2444784 0.78 MAPT (0.46) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL8678899 0.76 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL1558107 0.76 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL30140567 0.76 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL10507470 0.73 HCRTR1 (0.56) ALDH1A1LMNAKMT2AMEN1FAAH
SCHEMBL8846825 0.73 LMNA (0.47) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL8498172 0.72 ALDH1A1 (0.54) ALDH1A1LMNASMN1; SMN2KDM4EKMT2A
SCHEMBL4221154 0.72 ALDH1A1 (0.54) ALDH1A1LMNASMN1; SMN2KMT2AGLA
SCHEMBL4806850 0.72 ALDH1A1 (0.54) ALDH1A1LMNASMN1; SMN2KMT2AGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5744512-A Coreactive photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-04-28 — — US claimed
US-5837746-A Coreactive photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-11-17 — — US disclosed
US-5744512-A Coreactive photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-04-28 — — US disclosed
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