SCHEMBL1047649

SCHEMBL1047649

[CH2]CCCOc1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KCNH2 Q12809 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ATM Q13315 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL1044851 0.93 MAPT (0.53) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL1047361 0.91 MAPT (0.51) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL6748734 0.91 MAPT (0.51) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL72510 0.88 CA12 (0.52) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL8434882 0.85 CA12 (0.61) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL9808262 0.85 MAPT (0.62) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL8778513 0.84 LTA4H (0.57) MAPTCA12CA1CA2CA7
SCHEMBL14984020 0.83 MAPT (0.60) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL30514009 0.83 MAPT (0.60) DRD2DRD4DRD3MAPTL3MBTL1
SCHEMBL1343630 0.83 CA12 (0.65) DRD2DRD4DRD3MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117384079-B Chiral N-alkyl indole compound and preparation method and application thereof 云南大学 2024-05-24 CN claimed
CN-117384079-A Chiral N-alkyl indole compound and preparation method and application thereof 云南大学 2024-01-12 CN claimed
CN-115536704-A Nitrogen bismuth octa-cycloalkyl bismuth compounds and synthesis method thereof 湖南大学 2022-12-30 CN claimed
CN-110981768-A Simple synthesis method of aryl difluoroalkyl sulfoxide compound 山东理工大学 2020-04-10 CN claimed
CN-117384079-B Chiral N-alkyl indole compound and preparation method and application thereof 云南大学 2024-05-24 CN disclosed
CN-117384079-A Chiral N-alkyl indole compound and preparation method and application thereof 云南大学 2024-01-12 CN disclosed
CN-115850666-A Trithiophene alkyl sulfonic acid polymer, and preparation method and application thereof 中国科学院化学研究所 2023-03-28 CN disclosed
US-20150224099-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMA CO LTD (JP) 2015-08-13 US disclosed
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
US-8987304-B2 Antituberculous composition comprising oxazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 US disclosed
US-8772268-B2 Bisphosphonamidate prodrugs and uses thereof THE JOHNS HOPKINS UNIVERSITY (US) 2014-07-08 US disclosed
US-20130090311-A1 BISPHOSPHONAMIDATE PRODRUGS AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2013-04-11 US disclosed
US-4918045-A SUPPORTS, MICROCAPSULES CONTAINING COLORLESS ELECTRON-DONATING COLOR FORMER AND SOLVENT, AND ELECTRON-ACCEPTING DEVELOPER FUJI PHOTO FILM CO., LTD. (JP) 1990-04-17 US disclosed
US-4876233-A NICKEL COMPOUNDS; COLORFASTNESS FUJI PHOTO FILM CO., LTD. (JP) 1989-10-24 US disclosed
US-4870048-A COLORFAST IMAGE, LIGHT RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1989-09-26 US disclosed
EP-0286041-A1 Imidazothiadiazine derivatives, a process for preparing the same and their use as medicaments HOECHST JAPAN LIMITED (JP) 1988-10-12 EP disclosed
EP-0193813-A1 Pyridine derivatives and fungicides containing them BASF Aktiengesellschaft (DE) 1986-09-10 EP disclosed
US-4590291-A Thrombin inhibitory new dihydroxybenzene ether derivatives BAYER AKTIENGESELLSCHAFT (DE) 1986-05-20 US disclosed
EP-0068250-A1 Dioxybenzene ether derivatives, pharmaceutical compositions containing them, process for the preparation thereof and their use BAYER AG (DE) 1983-01-05 EP disclosed
US-4147869-A ADRENERGIC BLOCKING AGENTS FOR TREATMENT OF ANGINA PECTORIS, ARRHYTHMIA AND HYPERTENSION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1979-04-03 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 (2 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-20150224099-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OXA1L, ARG1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 DRD2 2614/4885DRD4 888/4885DRD3 1127/4885
US-20130090311-A1 BISPHOSPHONAMIDATE PRODRUGS AND USES THEREOF BPGM, PHPT1, PFKFB2 DRD2 4055/4885DRD4 4403/4885DRD3 4128/4885

“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.