SCHEMBL3989151

SCHEMBL3989151

C=CCNCCC(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
TSHR P16473 4/20 0.48
CA12 O43570 4/20 0.45
CA14 Q9ULX7 4/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX2 P34913 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.38
CA7 P43166 2/20 0.37
CA9 Q16790 2/20 0.37
KDM4E B2RXH2 3/20 0.36
CA2 P00918 1/20 0.36
LTA4H P09960 1/20 0.36
POLB P06746 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
SCHEMBL7774674 0.88 ALDH1A1 (0.56) LMNAALDH1A1TSHRCA12CA14
SCHEMBL1439008 0.82 MGAM (0.45) ALDH1A1TSHRKMT2ASMN1; SMN2MAPT
SCHEMBL30987140 0.82 LMNA (0.58) LMNAALDH1A1TSHRCA12CA14
SCHEMBL23521793 0.81 ALDH1A1 (0.38) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL72889 0.79 TSHR (0.67) LMNAALDH1A1TSHRCA12CA14
SCHEMBL713525 0.78
SCHEMBL7770641 0.77 TSHR (0.47) LMNAALDH1A1TSHREPHX2SMN1; SMN2
SCHEMBL12847508 0.77 TSHR (0.63) LMNAALDH1A1TSHRCA12CA14
SCHEMBL10042464 0.77 TSHR (0.63) LMNAALDH1A1TSHRCA12CA14
Hydrochloric Acid SCHEMBL929671 0.77 LMNA (0.47) LMNAALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116148398-B Method for detecting trace chemical hazard in fat-rich food 北京市疾病预防控制中心 2023-09-05 CN claimed
CN-116148398-A Method for detecting trace chemical hazard in fat-rich food 北京市疾病预防控制中心 2023-05-23 CN claimed
CN-115216073-B Oil-resistant corrosion-resistant shore power cable sheath material and preparation method thereof 广东安拓普聚合物科技有限公司 2023-05-16 CN claimed
CN-115216073-A Oil-resistant corrosion-resistant shore power cable sheath material and preparation method thereof 广东安拓普聚合物科技有限公司 2022-10-21 CN claimed
CN-116148398-B Method for detecting trace chemical hazard in fat-rich food 北京市疾病预防控制中心 2023-09-05 CN disclosed
CN-116148398-A Method for detecting trace chemical hazard in fat-rich food 北京市疾病预防控制中心 2023-05-23 CN disclosed
CN-115216073-B Oil-resistant corrosion-resistant shore power cable sheath material and preparation method thereof 广东安拓普聚合物科技有限公司 2023-05-16 CN disclosed
CN-115216073-A Oil-resistant corrosion-resistant shore power cable sheath material and preparation method thereof 广东安拓普聚合物科技有限公司 2022-10-21 CN disclosed
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US disclosed
WO-2009067547-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 WO disclosed
EP-1064254-B1 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIV SASKATCHEWAN (CA) 2007-10-17 EP disclosed
US-6984754-B1 Aliphatic amino carboxylic and amino phosphonic acids amino nitriles and amino tetrazoles as cellular rescue agents UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 2006-01-10 US disclosed
WO-1999048858-A2 ALIPHATIC AMINO CARBOXYLIC AND AMINO PHOSPHONIC ACIDS, AMINO NITRILES AND AMINO TETRAZOLES AS CELLULAR RESCUE AGENTS UNIVERSITY OF SASKATCHEWAN TECHNOLOGIES INC. (CA) 1999-09-30 WO disclosed
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed
WO-1997020964-A1 COMPOSITION AND PROCESS FOR ZINC PHOSPHATE CONVERSION COATING HENKEL CORPORATION (US) 1997-06-12 WO disclosed
EP-0711813-A2 Coating varnish composition and antifouling coating composition Hitachi Chemical Co., Ltd. (JP) 1996-05-15 EP disclosed
EP-0018549-B1 TETRAHYDROISOQUINOLINE COMPOUNDS, PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Tanabe Seiyaku Co., Ltd. (JP) 1981-12-30 EP disclosed
US-4294832-A HYPOTENSIVE AGENTS, ANGIOTENSIN INHIBITORS TANABE SEIYAKU CO., LTD. (JP) 1981-10-13 US disclosed
EP-0018549-A2 Tetrahydroisoquinoline compounds, process for preparing them and pharmaceutical compositions containing them Tanabe Seiyaku Co., Ltd. (JP) 1980-11-12 EP disclosed
US-4025550-A Derivatives of triiodo-aminobenzenecarboxylic acids and the preparation thereof CHEMIE LINZ AKTIENGESELLSCHAFT (OE) 1977-05-24 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-20090291938-A1 POLO-LIKE KINASE INHIBITORS PLK1, PLK2, POLK LMNA 1422/4885ALDH1A1 4009/4885TSHR 4284/4885

“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.