SCHEMBL4045310

SCHEMBL4045310

CC(O)COc1ccc(Oc2ccccc2F)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
PARP10 Q53GL7 1/20 0.49
LPAR1 Q92633 11/20 0.44
LPAR5 Q9H1C0 11/20 0.44
FAAH O00519 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
CYP2D6 P10635 1/20 0.39
ADRB3 P13945 1/20 0.39
CXCL8 P10145 1/20 0.39
EGFR P00533 1/20 0.39
LCK P06239 1/20 0.39

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
SCHEMBL4045628 0.86 PARP10 (0.48) LMNAPARP10LPAR1LPAR5FAAH
SCHEMBL13894250 0.83 LMNA (0.55) LMNAKDM4EALDH1A1KMT2AADRB2
SCHEMBL4045199 0.82 LMNA (0.58) LMNAKMT2A
SCHEMBL1496544 0.80 LMNA (0.85) LMNAADRB2ADRB1CYP2D6ADRB3
SCHEMBL9713476 0.80 LMNA (0.85) LMNAADRB2ADRB1CYP2D6ADRB3
SCHEMBL4046461 0.80 LMNA (0.85) LMNAADRB2ADRB1CYP2D6ADRB3
SCHEMBL1840653 0.79 LMNA (0.64) LMNAKMT2A
SCHEMBL6273026 0.79 LMNA (0.64) LMNAKMT2A
SCHEMBL1835550 0.79 LMNA (0.64) LMNAKMT2A
SCHEMBL6293051 0.77 PARP10 (0.66) LMNAPARP10LPAR1LPAR5FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1380342-B1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL CO (JP) 2009-07-01 EP disclosed
US-6995110-B2 Complex catalyst, process for producing the complex catalyst, and process for producing alcohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-02-07 US disclosed
US-20040077487-A1 Complex catalyst, process for producing the complex catalyst, and process for producing alchohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-04-22 US disclosed
EP-1380342-A1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-01-14 EP disclosed