SCHEMBL27146

SCHEMBL27146

[CH2]C(=O)c1ccc(Br)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.62
CES1 P23141 1/20 0.62
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
GSK3B P49841 2/20 0.52
OGG1 O15527 1/20 0.50
LMNA P02545 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL3282811 0.93 CES2 (0.54) CES2CES1CA1CA2GSK3B
Ethylene SCHEMBL10490014 0.78 LMNA (0.67) CES2CES1CA1CA2GSK3B
SCHEMBL615632 0.78 CES2 (0.62) CES2CES1CA1CA2GSK3B
SCHEMBL3842531 0.77 LMNA (0.73) CES2CES1CA1CA2GSK3B
SCHEMBL557285 0.77 CES2 (1.00) CES2CES1CA1CA2GSK3B
SCHEMBL9126141 0.77 LMNA (0.73) CES2CES1CA1CA2GSK3B
SCHEMBL132367 0.77 LMNA (0.73) CES2CES1CA1CA2GSK3B
SCHEMBL1442016 0.77 MAPT (0.44) CA1CA2GSK3BLMNAMEN1
Hydrochloric Acid SCHEMBL5283915 0.76 CES2 (0.59) CES2CES1CA1CA2GSK3B
Hydrochloric Acid SCHEMBL4372828 0.76 CES2 (0.59) CES2CES1CA1CA2GSK3B

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 1951 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116239647-A Benzimidazole alkyl bromide-timosaponin derivative and preparation method and application thereof 云南大学 2023-06-09 CN claimed
CN-110078717-B Bis-benzofuran-benzimidazole salt compound with anti-tumor activity and preparation method thereof 红河学院 2022-04-26 CN claimed
EP-2955575-B1 RESIST COMPOSITION, RESIST PATTERN FORMATION METHOD, AND POLYPHENOL DERIVATIVE USED IN SAME MITSUBISHI GAS CHEMICAL CO (JP) 2020-07-29 EP claimed
CN-108299401-B 3-benzyl substituted coumarin-imidazole salt compound and preparation method thereof 红河学院 2020-06-30 CN claimed
US-10377734-B2 Resist composition, method for forming resist pattern, polyphenol derivative for use in the composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-08-13 US claimed
US-9897913-B2 Radiation-sensitive composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-02-20 US claimed
US-9714560-B2 Protected scale inhibitors and methods relating thereto HALLIBURTON ENERGY SERVICES, INC. (US) 2017-07-25 US claimed
EP-2132201-B1 NOVEL 2-HETEROARYL SUBSTITUTED BENZOTHIOPHENES AND BENZOFURANES ASTRAZENECA AB (SE) 2016-11-16 EP claimed
US-9493469-B2 Piperidine inhibitors of Janus kinase 3 AUSPEX PHARMACEUTICALS, INC. (US) 2016-11-15 US claimed
US-8957215-B2 Heteroaryl substituted benzothiazoles NAVIDEA BIOPHARMACEUTICALS, INC. (US) 2015-02-17 US claimed
US-4053286-A ACYLATION MERCK & CO., INC. (US) 1977-10-11 US claimed
US-4051132-A Process for epimerizing beta-lactam antibiotic compounds by means of an acid quench MERCK & CO., INC. (US) 1977-09-27 US claimed
US-4031082-A Process for preparing 3-acycloxymethyl-2-cephem compounds ELI LILLY AND COMPANY (US) 1977-06-21 US claimed
US-4029651-A ESTERIFICATION ELI LILLY AND COMPANY (US) 1977-06-14 US claimed
US-4016155-A Process for preparing cephalosporin derivatives SANKYO COMPANY LIMITED (JA) 1977-04-05 US claimed
US-4014873-A Process for the production of 7-acylamidocephalosporins MERCK & CO., INC. (US) 1977-03-29 US claimed
US-3997533-A Process for the preparation of 7-acylamino-desacetoxycephalosporanic derivatives BAYER AKTIENGESELLSCHAFT (DT) 1976-12-14 US claimed
US-3978078-A Process for the preparation of ampicillin RHONE-POULENC S.A. (FR) 1976-08-31 US claimed
US-3962224-A CHEMICAL INTERMEDIATES FOR ANTIBIOTICS MERCK & CO., INC. (US) 1976-06-08 US claimed
US-3953437-A Process of preparing cephalosporanic acid ester derivatives YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) 1976-04-27 US 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-10377734-B2 Resist composition, method for forming resist pattern, polyphenol derivative for use in the composition HEATR1, HSP90AB1, HSP90AA1 CES2 3244/4885CES1 3870/4885CA1 4103/4885

“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.