SCHEMBL597666

SCHEMBL597666

Cc1ccc2c(c1)CC(C)CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.42
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 1/20 0.42
ACHE P22303 1/20 0.42
DRD2 P14416 5/20 0.39
DRD3 P35462 4/20 0.39
DRD4 P21917 2/20 0.39
MAPT P10636 3/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SLC6A4 P31645 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 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
SCHEMBL79036 0.92 ALDH1A1 (0.42) SRD5A1ALDH1A1CYP3A4ACHEDRD2
SCHEMBL31236154 0.83 ACHE (0.47) SRD5A1ALDH1A1CYP3A4ACHEMAPT
SCHEMBL30930042 0.83 ACHE (0.47) SRD5A1ALDH1A1CYP3A4ACHEMAPT
SCHEMBL27246033 0.83 ACHE (0.47) SRD5A1ALDH1A1CYP3A4ACHEMAPT
SCHEMBL80428 0.83 ACHE (0.47) SRD5A1ALDH1A1CYP3A4ACHEMAPT
Hydrochloric Acid SCHEMBL31426377 0.81 ACHE (0.46) SRD5A1ALDH1A1CYP3A4ACHEMAPT
SCHEMBL13184629 0.80 ALDH1A1 (0.47) SRD5A1ALDH1A1CYP3A4ACHEMAPT
SCHEMBL23607149 0.78 DRD2 (0.62) ALDH1A1ACHEDRD2DRD3MAPT
SCHEMBL16233587 0.78 PNMT (0.47) SRD5A1DRD2DRD3DRD4HTR2A
SCHEMBL11985168 0.78 GRIN2B (0.43) ALDH1A1DRD2DRD3DRD4MAPT

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109929328-B Composite ink and preparation method and device thereof TCL科技集团股份有限公司 2021-10-22 CN claimed
US-20200373508-A1 ELECTROLUMINESCENT MATERIAL INK AND ELECTROLUMINESCENT DEVICE THEREOF GUANGDONG JUHUA PRINTED DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-11-26 US claimed
CN-108948865-B Electroluminescent material ink and electroluminescent device thereof 广东聚华印刷显示技术有限公司 2020-07-10 CN claimed
CN-109929328-A A kind of compound ink and preparation method thereof, device TCL集团股份有限公司 2019-06-25 CN claimed
CN-108948865-A Electroluminescent material ink and its electroluminescent device 广东聚华印刷显示技术有限公司 2018-12-07 CN claimed
US-11637257-B2 Electroluminescent material ink and electroluminescent device thereof GUANGDONG JUHUA PRINTED DISPLAY TECHNOLOGY CO. LTD (CN) 2023-04-25 US disclosed
CN-109929328-B Composite ink and preparation method and device thereof TCL科技集团股份有限公司 2021-10-22 CN disclosed
US-20200373508-A1 ELECTROLUMINESCENT MATERIAL INK AND ELECTROLUMINESCENT DEVICE THEREOF GUANGDONG JUHUA PRINTED DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-11-26 US disclosed
CN-108948865-B Electroluminescent material ink and electroluminescent device thereof 广东聚华印刷显示技术有限公司 2020-07-10 CN disclosed
CN-109929328-A A kind of compound ink and preparation method thereof, device TCL集团股份有限公司 2019-06-25 CN disclosed
CN-108948865-A Electroluminescent material ink and its electroluminescent device 广东聚华印刷显示技术有限公司 2018-12-07 CN disclosed
US-20120202766-A1 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS PHARMASSET, INC. (US) 2012-08-09 US disclosed
US-20040162408-A1 PROCESS FOR THE MANUFACTURE OF TEMPERATURE-SENSITIVE POLYMERS SOLUTIA INC. (US) 2004-08-19 US disclosed
US-20030176319-A1 For therapy and prophylaxis of human immunodeficiency virus (HIV) and hepatitis B virus (HBV) infections, in human patients or other animal hosts GILEAD PHARMASSET LLC 2003-09-18 US disclosed
US-20030162992-A1 Reacting a 2,2-dialkoxyethyl halide with an appropriate carboxylate compound to obtain acetal compound; hydrolyzing the acetal to form the alpha -acyloxyacetaldehyde PHARMASSET, INC. 2003-08-28 US disclosed
WO-2003063771-A2 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS PHARMASSET LTD. (BB) 2003-08-07 WO disclosed
WO-2003051298-A2 PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF ANTIVIRAL NUCLEOSIDES PHARMASSET LTD. (BB) 2003-06-26 WO disclosed
WO-2003051306-A2 N4-ACYLCYTOSINE-1,3-DIOXOLANE NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS PHARMASSET LTD. (BB) 2003-06-26 WO disclosed
US-20020165421-A1 Process for the manufacture of temperature-sensitive polymers SOLUTIA INC. 2002-11-07 US disclosed
US-3997616-A FROM ALKENYLBENZENE, CYCLIZATION CATALYST TEIJIN LIMITED (JA) 1976-12-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030176319-A1 For therapy and prophylaxis of human immunodeficiency virus (HIV) and hepatitis B virus (HBV) infections, in human patients or other animal hosts ENTPD5, CDA, ADA SRD5A1 364/4885ALDH1A1 645/4885CYP3A4 740/4885
US-20030162992-A1 Reacting a 2,2-dialkoxyethyl halide with an appropriate carboxylate compound to obtain acetal compound; hydrolyzing the acetal to form the alpha -acyloxyacetaldehyde DERA, DPYD, DHPS SRD5A1 682/4885ALDH1A1 14/4885CYP3A4 1525/4885
US-20120202766-A1 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS ENTPD5, DUT, NT5C3B SRD5A1 530/4885ALDH1A1 2341/4885CYP3A4 369/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.