SCHEMBL9893462

SCHEMBL9893462

CCC(=O)OCCC(CC=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CHRM1 P11229 5/20 0.39
CHRM3 P20309 5/20 0.39
CHRM2 P08172 4/20 0.39
CHRM4 P08173 4/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.37
F2 P00734 1/20 0.37

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
SCHEMBL9893581 0.85 CYP1A2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4CYP1A2
SCHEMBL9893611 0.79 KDM4E (0.40) KDM4ESMN1; SMN2KMT2AHTTALDH1A1
SCHEMBL1546516 0.76 AOC3 (0.40) CYP1A2CYP2D6SMN1; SMN2PKMNPSR1
SCHEMBL11153183 0.76 HCAR2 (0.41) KDM4ECYP2D6KMT2ALMNAALDH1A1
SCHEMBL28171457 0.74 NAAA (0.47) SMN1; SMN2CHRM1CHRM3CHRM2CHRM4
SCHEMBL9893354 0.74 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4KDM4E
SCHEMBL4994413 0.73 POLB (0.43) KDM4EALDH1A1
SCHEMBL28034758 0.73 NAAA (0.54) KDM4ESMN1; SMN2HTTLMNATDP1
SCHEMBL9254662 0.73 TRPA1 (0.42) KDM4ECYP1A2CYP2D6SMN1; SMN2PKM
SCHEMBL4864892 0.72 CCR5 (0.45) CYP1A2CYP2D6SMN1; SMN2PKMNPSR1

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