SCHEMBL332835

SCHEMBL332835

CC[CH]OC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TSHR P16473 4/20 0.52
F2 P00734 1/20 0.50
TDP1 Q9NUW8 4/20 0.47
CYP2D6 P10635 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 3/20 0.46
SLC6A3 Q01959 2/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
SLC6A2 P23975 1/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 3/20 0.44
HSD17B10 Q99714 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42

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
SCHEMBL4189905 0.85 LMNA (0.55) LMNATSHRF2TDP1CYP2D6
SCHEMBL27343099 0.82 LMNA (0.52) LMNATSHRF2TDP1CYP1A2
SCHEMBL2434553 0.81 LMNA (0.50) LMNATSHRF2TDP1CYP2D6
SCHEMBL2434555 0.81 LMNA (0.50) LMNATSHRF2TDP1CYP2D6
SCHEMBL5002852 0.80 LMNA (0.50) LMNATSHRF2TDP1MAPK1
SCHEMBL11518347 0.79 ALDH1A1 (0.50) LMNATSHRTDP1KMT2AMAPK1
SCHEMBL9667200 0.79 LMNA (0.49) LMNATSHRF2TDP1CYP2D6
SCHEMBL21693932 0.79 CES2 (0.49) LMNATSHRTDP1ALDH1A1CES2
SCHEMBL9207472 0.79 ALDH1A1 (0.60) LMNATSHRTDP1CYP1A2CYP2C19
Alcohol SCHEMBL28171595 0.78 LMNA (0.52) LMNATSHRF2TDP1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143002-A Preparation method of indolinyl acetone 浙江工业大学 2023-12-01 CN claimed
EP-0766670-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH R&D LTD (GB) 2002-03-27 EP claimed
US-5530128-A ENZYME INHIBITOR AS ANTITUMOR AGENT CELLTECH THERAPEUTICS LIMITED (GB) 1996-06-25 US claimed
US-4450109-A VASODILATION; CARDIOTONIC AGENTS; HYPOTENSIVE AGENTS SS PHARMACEUTICAL CO., LTD. (JP) 1984-05-22 US claimed
US-4315855-A Monoazo disperse dyes containing a nitrophenyl group and a homophthalimide group BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US claimed
US-4264494-A Chromium complex dyestuffs for natural polyamides and synthetic nylons BASF AKTIENGESELLSCHAFT (DE) 1981-04-28 US claimed
US-4212801-A Unsymmetrical 1:2-chromium complexes containing an azo and an azomethine bond BASF AKTIENGESELLSCHAFT (DE) 1980-07-15 US claimed
CN-117143002-A Preparation method of indolinyl acetone 浙江工业大学 2023-12-01 CN disclosed
CN-117143002-A Preparation method of indolinyl acetone 浙江工业大学 2023-12-01 CN disclosed
US-20220204540-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2022-06-30 US disclosed
CN-110382083-B Method for depleting organosilicon components in mixtures using adsorbent copolymers and device for carrying out said method 美国陶氏有机硅公司 2022-03-29 CN disclosed
EP-3962900-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF ISAGRO S.p.A. (IT) 2022-03-09 EP disclosed
EP-3463618-B1 METHOD OF DEPLETING A VOLATILE COMPONENT IN A MIXTURE USING A CROSSLINKED ELASTOMER SORBENT DOW SILICONES CORP (US) 2022-01-12 EP disclosed
US-4264494-A Chromium complex dyestuffs for natural polyamides and synthetic nylons BASF AKTIENGESELLSCHAFT (DE) 1981-04-28 US disclosed
US-4247694-A PHOTOSTABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1981-01-27 US disclosed
US-4212801-A Unsymmetrical 1:2-chromium complexes containing an azo and an azomethine bond BASF AKTIENGESELLSCHAFT (DE) 1980-07-15 US disclosed
EP-0007633-A2 Cephem compounds, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-06 EP disclosed
US-4152163-A Silver halide photographic emulsion containing cyanine and hemicyanine sensitizing dyes FUJI PHOTO FILM CO., LTD. (JP) 1979-05-01 US disclosed
US-4036825-A DYES FOR CELLULOSE OR NITROGEN-CONTAINING FIBERS HOECHST AKTIENGESELLSCHAFT (DT) 1977-07-19 US disclosed
US-4035350-A Process for the preparation of water-soluble azo dyestuffs by reacting an aromatic amine and a coupling component with alkali metal nitrite or alkyl nitrite in the absence of acid HOECHST AKTIENGESELLSCHAFT (DT) 1977-07-12 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 (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-20220204540-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF ACHE, CYP51A1, DNPH1 LMNA 1454/4885TSHR 3995/4885F2 2594/4885

“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.