SCHEMBL4135870

SCHEMBL4135870

COc1c(C(C)=O)ccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.61
CYP1A1 P04798 1/20 0.60
CYP1B1 Q16678 1/20 0.60
LMNA P02545 2/20 0.52
RAB9A P51151 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 2/20 0.52
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 1/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
HCRTR1 O43613 1/20 0.46

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
SCHEMBL18288048 0.87 HPGD (0.63) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL11057805 0.86 HPGD (0.47) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL1671110 0.86 CYP1A1 (0.64) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL6621295 0.84 HPGD (0.46) HPGDCYP1A1CYP1B1ALDH1A1KDM4E
SCHEMBL5963449 0.84 HPGD (0.62) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL2747356 0.84 HPGD (0.60) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL1383189 0.84 HPGD (0.60) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL18288086 0.81 CYP1A1 (0.59) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL2747220 0.81 PLK1 (0.60) HPGDCYP1A1CYP1B1LMNARAB9A
SCHEMBL4828413 0.81 HPGD (0.57) HPGDCYP1A1CYP1B1LMNARAB9A

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109914-A1 IMIDAZOTHIAZOLE COMPOUNDS AND ANALOGS THEREOF AND METHODS FOR TREATING NEMATODE INFECTIONS IN PLANTS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2024-04-04 US disclosed
CN-114796169-A Application of 2-methoxynaphthalene in preparation of product for resisting skin photodamage 中国农业大学 2022-07-29 CN disclosed
CN-217043773-U Washing device for preparing ethyl naphthyl methyl ether 宁夏派可威生物科技有限公司 2022-07-26 CN disclosed
WO-2022150920-A1 IMIDAZOTHIAZOLE COMPOUNDS AND ANALOGS THEREOF AND METHODS FOR TREATING NEMATODE INFECTIONS IN PLANTS The Governing Council of the University of Toronto (CA) 2022-07-21 WO disclosed
WO-2022050774-A1 NOVEL IMIDAZOLE DERIVATIVE SALT HAVING ANTIFUNGAL ACTIVITY, AND USE THEREOF 경희대학교 산학협력단 2022-03-10 WO disclosed
CN-113845417-A Method for synthesizing (+/-) -naproxen by oxidation through continuous flow microchannel reactor 浙江车头制药股份有限公司 2021-12-28 CN disclosed
WO-2021125905-A1 NOVEL THIAZOLE DERIVATIVE AND USE THEREOF 가천대학교 산학협력단 2021-06-24 WO disclosed
WO-2021125905-A1 NOVEL THIAZOLE DERIVATIVE AND USE THEREOF 가천대학교 산학협력단 2021-06-24 WO disclosed
CN-108530278-A A kind of preparation method of D, L- naproxen 江苏八巨药业有限公司 2018-09-14 CN disclosed
WO-2014083156-A2 HYDROCARBON MARKERS O'REILLY JOHN (IE) 2014-06-05 WO disclosed
US-20090252791-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A TRIPTAN AND A NONSTEROIDAL ANTI-INFLAMMATORY DRUG DR. REDDY'S LABORATORIES, INC. 2009-10-08 US disclosed
US-20090252791-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A TRIPTAN AND A NONSTEROIDAL ANTI-INFLAMMATORY DRUG DR. REDDY'S LABORATORIES, INC. 2009-10-08 US disclosed
US-20090252791-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A TRIPTAN AND A NONSTEROIDAL ANTI-INFLAMMATORY DRUG DR. REDDY'S LABORATORIES, INC. 2009-10-08 US disclosed
US-20090018150-A1 5-Ht2b Receptor Antagonists ASTERAND UK LIMITED (GB) 2009-01-15 US disclosed
EP-1648876-A1 5-HT SB 2B /SB RECEPTOR ANTAGONISTS Pharmagene Laboratories Ltd (GB) 2006-04-26 EP disclosed
WO-2005012263-A1 5-HT2B RECEPTOR ANTAGONISTS PHARMAGENE LABORATORIES LIMITED (GB) 2005-02-10 WO disclosed
EP-0426846-A1 FLUORINATED-AROMATIC SULFONIC ACID CATALYST, PROCESS FOR ITS PRODUCTION, AND ITS USE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-05-15 EP 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 (3 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-20090018150-A1 5-Ht2b Receptor Antagonists HTR2B, HTR1B, HTR3B HPGD 1962/4885CYP1A1 921/4885CYP1B1 414/4885
US-20090252791-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A TRIPTAN AND A NONSTEROIDAL ANTI-INFLAMMATORY DRUG PTGES, PTGES3, PTGIS HPGD 168/4885CYP1A1 810/4885CYP1B1 1583/4885
US-20240109914-A1 IMIDAZOTHIAZOLE COMPOUNDS AND ANALOGS THEREOF AND METHODS FOR TREATING NEMATODE INFECTIONS IN PLANTS NISCH, ABAT, ICMT HPGD 458/4885CYP1A1 454/4885CYP1B1 198/4885

“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.