SCHEMBL3671585

SCHEMBL3671585

Cc1cc(C(=O)C2(O)CCCCC2)ccc1COCc1cc(C(=O)C2(O)CCCCC2)ccc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.34
MAOB P27338 1/20 0.34
KDM2B Q8NHM5 2/20 0.34
KDM4E B2RXH2 1/20 0.32
XBP1 P17861 1/20 0.32
RXRA P19793 2/20 0.31
KMT2A Q03164 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
ALDH1A1 P00352 4/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MMP1 P03956 1/20 0.31
HTT P42858 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL3669312 0.95 MRGPRX4 (0.37) MRGPRX4KDM2BKDM4EXBP1KMT2A
SCHEMBL3672849 0.95 KDM2B (0.36) MAOBKDM2BKDM4EXBP1RXRA
SCHEMBL3677668 0.91 S1PR1 (0.31) MRGPRX4KDM2BS1PR1S1PR3
SCHEMBL3676447 0.86 S1PR1 (0.33) KDM2BS1PR1S1PR3
SCHEMBL3674292 0.86 CYP2D6 (0.32) MRGPRX4KDM2B
SCHEMBL3672637 0.81 KDM2B (0.35) KDM2BKDM4EXBP1RXRAKMT2A
SCHEMBL3670675 0.81 PKM (0.41) KDM2BKDM4EXBP1KMT2AALDH1A1
SCHEMBL3671001 0.79 KDM4E (0.44) KDM4EXBP1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3674362 0.74 KDM2B (0.34) KDM2BKDM4EXBP1RXRAKMT2A
SCHEMBL3672416 0.72 MRGPRX4 (0.38) MRGPRX4MAOBS1PR1S1PR3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642296-B2 2-hydroxy-1-(4-hydroxymethyl-phenyl)-2-methyl-propan-1-one, have higher reactivity at the benzylic hydroxy group and do not have a tendency to yellowing; photocurable composition for pigmented or non-pigmented varnish surface coatings CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-05 US disclosed
US-20070240609-A1 Photoinitiators IGM GROUP B.V. (NL) 2007-10-18 US disclosed
EP-1763499-B1 NEW PHOTOINITIATORS CIBA SC HOLDING AG (CH) 2007-09-26 EP disclosed
EP-1763499-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-21 EP disclosed
WO-2005100292-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-10-27 WO disclosed