SCHEMBL721250

SCHEMBL721250

c1ccc(CC[N]CCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.56
MIF P14174 3/20 0.56
CYP2A6 P11509 2/20 0.56
TRPA1 O75762 1/20 0.56
CYP2E1 P05181 1/20 0.56
CYP2A13 Q16696 1/20 0.56
EPAS1 Q99814 1/20 0.56
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
CASP1 P29466 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HTR2A P28223 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.50
GRIN1 Q05586 1/20 0.50
GRIN2B Q13224 1/20 0.50

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
SCHEMBL8897206 0.90 HTR3A (0.57) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL4699868 0.88 HTR2A (0.58) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL9819891 0.88 NAAA (0.60) MIFNAAAHTR3AMAPTSIGMAR1
SCHEMBL9819728 0.88 NAAA (0.60) MIFNAAAHTR3AMAPTSIGMAR1
SCHEMBL6560088 0.88 MIF (0.47) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL9819903 0.88 NAAA (0.60) MIFNAAAHTR3AMAPTSIGMAR1
SCHEMBL2643014 0.87 MIF (0.50) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL1885696 0.85 MIF (0.54) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL10431399 0.85 TDP1 (0.54) HIF1AMIFCYP2A6TRPA1CYP2E1
SCHEMBL9035864 0.84 KCNH2 (0.49) HIF1AMIFCYP2A6TRPA1CYP2E1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090043111-A1 Novel process for ropinirole preparation LIU MEIZHENG 2009-02-12 US claimed
EP-0873118-A1 TRANSDERMAL ADMINISTRATION OF ROPINIROLE AND ANALOGS THEREOF SMITHKLINE BEECHAM PLC (GB) 1998-10-28 EP claimed
US-5807570-A DOPAMINE AGONIST CYGNUS, INC. (US) 1998-09-15 US claimed
WO-1997011696-A1 TRANSDERMAL ADMINISTRATION OF ROPINIROLE AND ANALOGS THEREOF CYGNUS, INC. (US) 1997-04-03 WO claimed
US-4452808-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1984-06-05 US claimed
US-4406875-A Radiolabeled amine compounds and their use BYK-MALLINCKRODT CIL B.V. (NL) 1983-09-27 US claimed
WO-1980001685-A1 RADIOLABELED AMINE COMPOUNDS AND THEIR USE BYK MALLINCKRODT CIL BV (NL) 1980-08-21 WO claimed
US-4016263-A BACTERICIDES BOEHRINGER INGELHEIM GMBH (DT) 1977-04-05 US claimed
US-11980092-B2 Organic electroluminescence element HODOGAYA CHEMICAL CO., LTD. (JP) 2024-05-07 US disclosed
US-11925114-B2 Indenocarbazole compound and organic electroluminescence device HODOGAYA CHEMICAL CO., LTD. (JP) 2024-03-05 US disclosed
WO-2024005030-A1 DIPHENYLETHENE-BASED COMPOUND, LIGHT ABSORBER, RESIN COMPOSITION, AND USE THEREOF 山本化成株式会社 2024-01-04 WO disclosed
EP-3432688-B1 ORGANIC ELECTROLUMINESCENCE ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2023-12-20 EP disclosed
EP-3275969-B1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, LIGHT-EMITTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2023-10-04 EP disclosed
US-11718758-B2 Aqueous dispersion of colored particles MITSUBISHI PENCIL COMPANY, LIMITED (JP) 2023-08-08 US disclosed
US-4091210-A Preparation of 3-alkyl-3-cephem-4-carboxylic acid compounds from dithio isopropenyl azetidine carboxylic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1978-05-23 US disclosed
US-4084049-A CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1978-04-11 US disclosed
US-4028112-A MEROCYANINE DYE WITH OXAZOLE NUCLEUS FUJI PHOTO FILM CO., LTD. (JA) 1977-06-07 US disclosed
US-4016263-A BACTERICIDES BOEHRINGER INGELHEIM GMBH (DT) 1977-04-05 US disclosed
US-3962527-A Novel polymers and photographic elements containing same EASTMAN KODAK COMPANY (US) 1976-06-08 US disclosed
US-3954732-A BACTERICIDAL PENICILLINS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-05-04 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-20090043111-A1 Novel process for ropinirole preparation PAH, DRD4, DBH HIF1A 1421/4885MIF 2966/4885CYP2A6 918/4885
US-11925114-B2 Indenocarbazole compound and organic electroluminescence device OXA1L, KCNJ1, ABCB1 HIF1A 3570/4885MIF 1377/4885CYP2A6 771/4885

“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.