SCHEMBL5706342

SCHEMBL5706342

CC1(CCOc2cccc(OCCC3(C)COC3)c2)COC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.41
HTT P42858 2/20 0.41
TSHR P16473 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
HIF1A Q16665 1/20 0.40
MAPK1 P28482 2/20 0.39
ALOX5 P09917 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 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
SCHEMBL9936128 0.82 DHFR (0.46) ALDH1A1KDM4EHTTTSHRSMN1; SMN2
SCHEMBL12877672 0.76 DHFR (0.41) ALDH1A1TSHRSMN1; SMN2TP53CYP3A4
Resorcinol SCHEMBL5706345 0.73 CYP3A4 (0.39) ALDH1A1TSHRCYP3A4CYP1A2CHRNB2
SCHEMBL13726105 0.73 ACHE (0.43) ALDH1A1KDM4ETSHRMAPK1
SCHEMBL18904048 0.73 MAOB (0.43) ALDH1A1KDM4EHTTSMN1; SMN2CYP3A4
SCHEMBL12957966 0.73 KDM4E (0.46) ALDH1A1KDM4EHTTTSHRSMN1; SMN2
SCHEMBL12958210 0.72 ALDH1A1 (0.37) ALDH1A1KDM4EHTTTSHRSMN1; SMN2
SCHEMBL2623442 0.72 ALDH1A1 (0.45) ALDH1A1KDM4EHTT
SCHEMBL16373424 0.71 DRD2 (0.46) ALDH1A1KDM4ESMN1; SMN2CYP3A4CYP1A2
SCHEMBL15695585 0.71 SMN1; SMN2 (0.48) ALDH1A1KDM4EHTTTSHRSMN1; SMN2

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-20060220278-A1 Molding method of visible light curable fiber reinforced resin composite FUJI JUKOGYO KABUSHIKI KAISHA (JP) 2006-10-05 US disclosed
EP-1707343-A1 Molding method of visible light curable fiber reinforced resin composite FUJI JUKOGYO KABUSHIKI KAISHA (JP) 2006-10-04 EP disclosed
US-20050176889-A1 Polyalkenyl ether resin KYOWA HAKKO CHEMICAL CO. LTD. (JP) 2005-08-11 US disclosed
EP-1201638-B1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO (JP) 2004-06-23 EP disclosed
US-6677390-B1 CURABLE MIXTURES COMPRISING SENSITIZERS AND HALOGEN COMPOUNDS SUCH AS 4-CARBOXYMETHOXYPHENYL-2',4',6'-TRIMETHYLPHENYL-IODONIUM HEXAFLUOROPHOSPHATE, USED AS NONTOXIC ACID GENERATORS OR CATALYSTS; QUICK SETTING NIPPON SODA CO., LTD. (JP) 2004-01-13 US disclosed
EP-1201638-A1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO., LTD. (JP) 2002-05-02 EP disclosed