SCHEMBL60330

SCHEMBL60330

CC(=O)N1CCCCCC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
CYP1A2 P05177 1/20 0.57
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
EPHX2 P34913 2/20 0.48
EPHX1 P07099 1/20 0.48
HPGD P15428 2/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP3 P08254 1/20 0.46
MMP9 P14780 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
PIK3CD O00329 1/20 0.44
CA2 P00918 1/20 0.44
CHKA P35790 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL14506909 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19046575 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL14034527 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3438657 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL27023033 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL18228339 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8053 1.00
SCHEMBL896298 1.00
SCHEMBL17901788 1.00 TDP1 (0.57) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL8522398 0.97 TDP1 (0.55) TDP1CYP1A2ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365561-A1 BETA-LACTAMASE INHIBITORS AND THEIR PREPARATION NINGXIA ACADEMY OF AGRICULTURE AND FORESTRY SCIENCES (CN) 2023-11-16 US disclosed
WO-2023220572-A1 PTPN2 INHIBITORS NESS THERAPEUTICS, INC. (US) 2023-11-16 WO disclosed
US-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 US disclosed
US-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 US disclosed
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 US disclosed
WO-2022135432-A1 MACROCYCLIC HETEROCYCLIC COMPOUNDS AS EGFR INHIBITORS, AND USE THEREOF 南京圣和药业股份有限公司 2022-06-30 WO disclosed
EP-3689875-B1 USE OF TRIAZOLOPYRIMIDINE, TRIAZOLOPYRIDINE COMPOUNDS AND COMPOSITION THEREOF FOR TREATING PRC2-MEDIATED DISEASES SHANGHAI INST MATERIA MEDICA CAS (CN) 2021-10-13 EP disclosed
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-05-11 US disclosed
EP-2813512-B1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI PHARMACEUTICAL CO LTD (JP) 2021-03-31 EP disclosed
US-10858352-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-12-08 US disclosed
EP-0654023-B1 5-(2-OXYPHENYL)-PYRROLE DERIVATIVES AS DOPAMINE D3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-09-16 EP disclosed
CN-1184123-A Organic optical component MITSUI TOATSU CHEMICALS (JP) 1998-06-10 CN disclosed
US-5523299-A ADMINISTERING IN TREATMENT OF PSYCHOTIC DISORDERS SMITHKLINE BEECHAM PLC (GB) 1996-06-04 US disclosed
EP-0654023-A1 5-(2-OXYPHENYL)-PYRROLE DERIVATIVES AS DOPAMINE D3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-05-24 EP disclosed
CN-1084169-A New phenylpyrrole derivative and its production and use SMITHKLINE BEECHAM PLC (GB) 1994-03-23 CN disclosed
WO-1994003426-A1 5-(2-OXYPHENYL)-PYRROLE DERIVATIVES AS DOPAMINE D3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-02-17 WO disclosed
US-4554252-A SUBSTITUTED AMIDE ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1985-11-19 US disclosed
US-4234484-A FROM ALKOXYLATED CYCLIC AMIDES USING AS A CATALYST A QUATERNARY AMMONIUM OR ALKALI METAL SALT OF TETRAFLUOROBORIC OR HEXAFLUOROPHOSPHORIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 1980-11-18 US disclosed
US-4149941-A ELECTROLYTIC ALKOXYLATION HOECHST AKTIENGESELLSCHAFT (DE) 1979-04-17 US disclosed
US-4118500-A Fungicidal alkoxy mono- and dialkoxy N-substituted cyclic amines HOECHST AKTIENGESELLSCHAFT (DE) 1978-10-03 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 (5 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-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 TDP1 884/4885CYP1A2 1393/4885ALDH1A1 1598/4885
US-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER XIAP, UBQLN1, MDM2 TDP1 1752/4885CYP1A2 4150/4885ALDH1A1 1206/4885
US-20230365561-A1 BETA-LACTAMASE INHIBITORS AND THEIR PREPARATION MGAM, LCT, GANAB TDP1 3367/4885CYP1A2 330/4885ALDH1A1 315/4885
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 TDP1 931/4885CYP1A2 1488/4885ALDH1A1 1601/4885
US-10858352-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 TDP1 2921/4885CYP1A2 312/4885ALDH1A1 2679/4885

“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.