SCHEMBL4987219

SCHEMBL4987219

CC(=O)OCCCCCCl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
LMNA P02545 2/20 0.46
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
TSHR P16473 4/20 0.43
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
PGR P06401 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
HTR1A P08908 1/20 0.43
CHRNB2 P17787 1/20 0.43
TBXA2R P21731 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRNA4 P43681 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHRNA10 Q9GZZ6 1/20 0.43

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
SCHEMBL5694217 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL10845203 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL9533237 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL1532527 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL8440104 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL14673470 1.00 ALDH1A1 (0.56) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL1270067 0.98
SCHEMBL408956 0.90
Phosphine SCHEMBL10880551 0.88
SCHEMBL4441760 0.87 ALDH1A1 (0.70) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4005126-A Preparation of haloalkyl esters UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-01-25 US claimed
US-4005125-A Preparation of haloalkyl esters UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-01-25 US claimed
US-20210085700-A1 TARGETED THERAPEUTICS MADRIGAL PHARMACEUTICALS, INC. 2021-03-25 US disclosed
US-10828315-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2020-11-10 US disclosed
US-20200316090-A1 TARGETED THERAPEUTICS SYNTA PHARMACEUTICALS CORP. 2020-10-08 US disclosed
US-10722525-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2020-07-28 US disclosed
US-10675360-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2020-06-09 US disclosed
US-10232049-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2019-03-19 US disclosed
US-9956293-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2018-05-01 US disclosed
US-9956293-B2 Targeted therapeutics MADRIGAL PHARMACEUTICALS, INC. (US) 2018-05-01 US disclosed
US-20170128580-A1 TARGETED THERAPEUTICS TARVEDA THERAPEUTICS, INC. 2017-05-11 US disclosed
US-4005125-A Preparation of haloalkyl esters UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-01-25 US disclosed
US-4005126-A Preparation of haloalkyl esters UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-01-25 US disclosed
US-3989749-A RENAL VASODILATORS, ANTITHROMBUS MERCK & CO., INC. (US) 1976-11-02 US disclosed
US-3987091-A RENAL VASODILATORS MERCK & CO., INC. (US) 1976-10-19 US disclosed
US-3966773-A BRONCHODILATOR, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1976-06-29 US disclosed
US-3950406-A BRONCHODILATORS, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1976-04-13 US disclosed
US-3932479-A BRONCHODILATOR, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1976-01-13 US disclosed
US-3932463-A BRONCHODILATORS, GASTRIC ACID SECRETION INHIBITORS AMERICAN CYANAMID COMPANY (US) 1976-01-13 US disclosed
US-3932472-A INHIBITORS OF GASTRIC ACID SECRETION AMERICAN CYANAMID COMPANY (US) 1976-01-13 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 (7 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-20200316090-A1 TARGETED THERAPEUTICS CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-20210085700-A1 TARGETED THERAPEUTICS CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-20170128580-A1 TARGETED THERAPEUTICS CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-10675360-B2 Targeted therapeutics CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-10232049-B2 Targeted therapeutics CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-10722525-B2 Targeted therapeutics CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885
US-10828315-B2 Targeted therapeutics CDC37, HSP90AB1, HSP90B1 ALDH1A1 3249/4885LMNA 3127/4885APOBEC3A 4049/4885

“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.