SCHEMBL9893620

SCHEMBL9893620

CCC(=O)OCCC([C]=O)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.35
▸ EPHX2 P34913 1/20 0.33
▸ TSHR P16473 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL9943520 0.91 NAAA (0.40) NAAAEPHX2TSHRALDH1A1CYP3A4
SCHEMBL9893415 0.84 ALOX15 (0.35) TSHRALDH1A1CYP3A4CHRM2HTR1A
SCHEMBL9943421 0.76 ALDH1A1 (0.38) EPHX2TSHRALDH1A1CHRM2HTR1A
SCHEMBL1335896 0.75 SHBG (0.41) ALDH1A1CYP1A2SHBGSMN1; SMN2
SCHEMBL9893406 0.74 ALDH1A1 (0.34) NAAAEPHX2TSHRALDH1A1CYP3A4
SCHEMBL22592812 0.73 NAAA (0.38) NAAAEPHX2TSHRALDH1A1CYP3A4
SCHEMBL6565897 0.72 NAAA (0.44) NAAAEPHX2TSHRNPSR1L3MBTL1
SCHEMBL6988843 0.72 SHBG (0.39) NAAAEPHX2TSHRCYP1A2SHBG
SCHEMBL22578931 0.72 NAAA (0.41) NAAAEPHX2TSHRALDH1A1CYP3A4
SCHEMBL9893520 0.71 NAAA (0.45) NAAAALDH1A1CYP1A2CHRNB2CHRNB4

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-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
CN-102471384-B Cellulose derivative, resin composition, molded body, method for producing molded body, and housing for electric and electronic devices FUJIFILM CORP 2015-06-17 — — CN 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
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