SCHEMBL2935940

SCHEMBL2935940

CCc1ccccc1C(=O)c1ccccc1CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
CLCN2 P51788 1/20 0.47
TSHR P16473 4/20 0.46
ALDH1A1 P00352 3/20 0.46
TP53 P04637 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
F2R P25116 1/20 0.44
HTT P42858 2/20 0.42
FOLH1 Q04609 1/20 0.42
ALOX15 P16050 1/20 0.42
HPGD P15428 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CDC25B P30305 1/20 0.41

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
SCHEMBL3953764 0.89 ALDH1A1 (0.56) CLCN2ALDH1A1SMN1; SMN2HTTFOLH1
SCHEMBL5402022 0.89 HPGD (0.51) TSHRALDH1A1MAPTHTTHPGD
SCHEMBL9461183 0.89 HPGD (0.50) GABRA1GABRB2TSHRALDH1A1GAA
SCHEMBL7837646 0.88 MAPT (0.45) GABRA1GABRB2CLCN2TSHRALDH1A1
SCHEMBL10374466 0.88 GAA (0.55) CLCN2TSHRALDH1A1TP53GAA
SCHEMBL28351438 0.88 ALDH1A1 (0.54) CLCN2ALDH1A1SMN1; SMN2HTTFOLH1
SCHEMBL19834695 0.88 MEN1 (0.42) GABRA1GABRB2CLCN2TSHRALDH1A1
SCHEMBL29881091 0.87 AKR1C3 (0.57) CLCN2TSHRALDH1A1GAAMAPT
SCHEMBL723171 0.87 AKR1C3 (0.57) CLCN2TSHRALDH1A1GAAMAPT
Benzophenone SCHEMBL28431035 0.85 ALDH1A1 (0.56) ALDH1A1GAAMAPTHPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109666396-A Novel water-based low-gloss ultraviolet curing coating and preparation and use methods thereof 张聪聪 2019-04-23 CN claimed
CN-109400932-A Heat-resisting release film of highly flexible ultraviolet curing and preparation method thereof 苏州泰仑电子材料有限公司 2019-03-01 CN claimed
CN-107652893-A VOC ecological wall finisses such as a kind of absorption decomposing formaldehyde and preparation method thereof 广东巴得劳建材科技有限公司 2018-02-02 CN claimed
CN-106752541-A A kind of aqueous polyurethane ultraviolet-curing paint and preparation method thereof 中山市鑫峰光固化材料有限公司 2017-05-31 CN claimed
CN-105218329-B Intermediate of liflozin analogues and preparation method of intermediate 上海应用技术学院 2017-05-03 CN claimed
CN-106167679-A Ultraviolet-curing paint for mould release membrance 苏州柯创电子材料有限公司 2016-11-30 CN claimed
CN-103909754-B The UV of a kind of UV base oil canister prints coating method 上海宝钢包装股份有限公司 2016-08-24 CN claimed
CN-103909753-B A kind of metal UV color printing product print coating method 上海宝钢包装股份有限公司 2016-08-10 CN claimed
CN-103483537-B A kind of UV-cured resin, its preparation method and with the coating prepared by it The large novel material of Hunan Ben Anya company limited (CN) 2015-09-16 CN claimed
CN-103909754-A Ultraviolet (UV) base oil metal tank UV printing and coating method SHANGHAI BAOSTEEL PACKING CO LTD 2014-07-09 CN claimed
CN-103483537-A UV curing resin, preparation method thereof and coating prepared therefrom HUNAN BEN AN YADA NEW MATERIALS CO LTD 2014-01-01 CN claimed
US-7442800-B2 Nucleophilic heterocyclic carbene derivatives of Pd(acac)2 for cross-coupling reactions PROMERUS LLC (US) 2008-10-28 US claimed
EP-1885669-A1 NUCLEOPHILIC HETEROCYCLIC CARBENE DERIVATIVES OF PD(ACAC)2 FOR CROSS-COUPLING REACTIONS Promerus LLC (US) 2008-02-13 EP claimed
US-20060287544-A1 Nucleophilic heterocyclic carbene derivatives of Pd(acac)2 for cross-coupling reactions PROMERUS LLC (US) 2006-12-21 US claimed
WO-2006128097-A1 NUCLEOPHILIC HETEROCYCLIC CARBENE DERIVATIVES OF PD(ACAC)2 FOR CROSS-COUPLING REACTIONS PROMERUS LLC (US) 2006-11-30 WO claimed
US-6462209-B1 CONTACTING LIQUID PROPYLENE OXIDE CONTAMINATED WITH POLY(PROPYLENE OXIDE) WITH AN ADSORBENT SELECTED FROM MAGNESIUM SILICATE AND CALCIUM SILICATE POWDERS; RESULTING SLURRY IS FILTERED YIELDING PURE PROPYLENE OXIDE SHELL OIL COMPANY 2002-10-08 US claimed
EP-0772609-B1 CYCLIC KETONE PEROXIDE FORMULATIONS AKZO NOBEL NV (NL) 1999-02-24 EP claimed
US-5808110-A TRANSPORTABLE; STORAGE STABLE AKZO NOBEL NV (NL) 1998-09-15 US claimed
EP-0772609-A1 CYCLIC KETONE PEROXIDE FORMULATIONS Akzo Nobel N.V. (NL) 1997-05-14 EP claimed
WO-1996003397-A1 CYCLIC KETONE PEROXIDE FORMULATIONS AKZO NOBEL N.V. (NL) 1996-02-08 WO claimed

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

For each of this compound's patents that has machine-readable text (1 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-20060287544-A1 Nucleophilic heterocyclic carbene derivatives of Pd(acac)2 for cross-coupling reactions NDC1, DDC, PDCD1LG2 GABRA1 3435/4885GABRB2 2368/4885CLCN2 1645/4885

“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.