SCHEMBL9893968

SCHEMBL9893968

CC(=O)OCCC(CC=O)c1cccc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.38
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RAD52 P43351 1/20 0.35
HTR2C P28335 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
SLC6A4 P31645 1/20 0.35
CA12 O43570 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35

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
SCHEMBL9893611 0.88 KDM4E (0.40) ALDH1A1HPGDCYP2C9CYP2C19HTT
SCHEMBL9893581 0.78 CYP1A2 (0.41) ALDH1A1MTNR1AMTNR1B
SCHEMBL9893388 0.76 ALDH1A1 (0.38) NPBWR1ALDH1A1HPGDCYP2C9CYP2C19
SCHEMBL614836 0.76 CYP2C9 (0.43) ALDH1A1HPGDCYP2C9CYP2C19HTT
SCHEMBL3381619 0.75 NPBWR1 (0.40) NPBWR1ALDH1A1HPGDCYP2C9CYP2C19
SCHEMBL27669570 0.75 NPBWR1 (0.41) NPBWR1ALDH1A1HPGDCYP2C9CYP2C19
SCHEMBL10869025 0.73 MTNR1A (0.48) ALDH1A1HPGDCYP2C9CYP2C19HTT
SCHEMBL9943711 0.72 ALDH1A1 (0.39) NPBWR1ALDH1A1HPGDCYP2C9CYP2C19
SCHEMBL9572849 0.70 ALDH1A1 (0.38) ALDH1A1CYP2C9CYP2C19SLC6A4
SCHEMBL4185219 0.70 ALDH1A1 (0.46) ALDH1A1HPGDCYP2C9CYP2C19HTT

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
US-9074020-B2 Cellulose derivative, resin composition, molded body, method for preparation thereof, and case for electric and electronic device FUJIFILM CORPORATION (JP) 2015-07-07 US disclosed
EP-2465874-B1 CELLULOSE DERIVATIVE, RESIN COMPOSITION, MOLDED ARTICLE AND PROCESS FOR PRODUCTION THEREOF, AND HOUSING FOR ELECTRIC AND ELECTRONIC DEVICE FUJIFILM CORP (JP) 2015-02-25 EP disclosed
EP-2465874-A1 CELLULOSE DERIVATIVE, RESIN COMPOSITION, MOLDED ARTICLE AND PROCESS FOR PRODUCTION THEREOF, AND HOUSING FOR ELECTRIC AND ELECTRONIC DEVICE FUJIFILM Corporation (JP) 2012-06-20 EP disclosed
US-20120146468-A1 CELLULOSE DERIVATIVE, RESIN COMPOSITION, MOLDED BODY, METHOD FOR PREPARATION THEREOF, AND CASE FOR ELECTRIC AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2012-06-14 US disclosed