SCHEMBL4041676

SCHEMBL4041676

COc1ccc2c(c1)CC(=O)C2

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.58
DRD2 P14416 7/20 0.55
DRD1 P21728 7/20 0.55
DRD5 P21918 7/20 0.55
DRD3 P35462 7/20 0.55
DRD4 P21917 5/20 0.49
MAOB P27338 1/20 0.47
GAA P10253 1/20 0.47
ACHE P22303 1/20 0.47
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
CYP19A1 P11511 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
CYP2C19 P33261 1/20 0.45
BCL2 P10415 1/20 0.44

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
SCHEMBL6903663 0.87 DRD1 (0.68) METAP1DRD2DRD1DRD5DRD3
SCHEMBL12595448 0.87
SCHEMBL6907774 0.87 DRD1 (0.68) METAP1DRD2DRD1DRD5DRD3
SCHEMBL227363 0.86 CYP1A2 (0.60) METAP1DRD2DRD1DRD5DRD3
SCHEMBL43307 0.86 METAP1 (0.53) METAP1DRD2DRD1DRD5DRD3
SCHEMBL29940518 0.86 METAP1 (0.53) METAP1DRD2DRD1DRD5DRD3
SCHEMBL12077840 0.85 METAP1 (0.51) METAP1DRD2DRD1DRD5DRD3
Ammonia Solution, Strong SCHEMBL1799116 0.85 DRD1 (0.66) METAP1DRD2DRD1DRD5DRD3
SCHEMBL3813236 0.83 DRD1 (0.52) METAP1DRD2DRD1DRD5DRD3
SCHEMBL228868 0.83 DRD1 (0.56) METAP1DRD2DRD1DRD5DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116239561-B Benzofluorene photochromic compound and application thereof 上海甘田光学材料有限公司 2025-02-28 CN disclosed
CN-116239561-A Benzofluorene photochromic compound and application thereof 上海甘田光学材料有限公司 2023-06-09 CN disclosed
US-11578077-B2 Spiro-oxazolones HOFFMANN-LA ROCHE INC. (US) 2023-02-14 US disclosed
US-20200039997-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2020-02-06 US disclosed
US-10479796-B2 Spiro-oxazolones HOFFMAN-LA ROCHE INC. (US) 2019-11-19 US disclosed
EP-3083633-B1 SPIRO-OXAZOLONES HOFFMANN LA ROCHE (CH) 2017-11-29 EP disclosed
US-20170008901-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2017-01-12 US disclosed
US-20170008901-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2017-01-12 US disclosed
EP-3083633-A1 SPIRO-OXAZOLONES F.HOFFMANN-LA ROCHE AG (CH) 2016-10-26 EP disclosed
US-9227930-B2 Aminoindane derivatives, pharmaceutical compositions containing them, and their use in therapy ABBVIE INC. (US) 2016-01-05 US disclosed
EP-0861837-B1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-04-28 EP disclosed
EP-1409468-A2 GUANIDINOBENZAMIDES AS MC4-R AGONISTS CHIRON CORPORATION (US) 2004-04-21 EP disclosed
US-6638927-B2 Melanocortin-4 receptor (MC4-R) agonists; treating obesity or diabetes; 4-((N-cyclohexyl-3,5-dimethyl-piperazine-1-carboximidoyl)-amino)-N-(2-(2,4 -dichlorophenyl) -ethyl)-benzamide for example CHIRON CORPORATION 2003-10-28 US disclosed
US-20030199499-A1 Novel guanidinobenzamides CHIRON CORPORATION 2003-10-23 US disclosed
US-20020137939-A1 Melanocortin-4 receptor (MC4-R) agonists; treating obesity or diabetes; 4-((N-cyclohexyl-3,5-dimethyl-piperazine-1-carboximidoyl)-amino)-N-(2-(2,4 -dichlorophenyl)-ethyl)-benzamide for example CHIRON CORPORATION 2002-09-26 US disclosed
WO-2002018327-A2 GUANIDINOBENZAMIDES AS MC4-R AGONISTS CHIRON CORPORATION (US) 2002-03-07 WO disclosed
US-5968954-A EXHIBIT SELECTIVE BINDING AFFINITY FOR 5-HYDROXYTRYPTAMINE RECEPTORS ADIR ET COMPAGNIE (FR) 1999-10-19 US disclosed
CN-1218051-A New 2,3-dioxide, indanol compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-06-02 CN disclosed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP disclosed
US-4975461-A Enzymes/oxidoreductases/inhibitors E. R. SQUIBB & SONS, INC. (US) 1990-12-04 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 (6 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-11578077-B2 Spiro-oxazolones AVPR1A, AVPR1B, AVPR2 METAP1 4200/4885DRD2 46/4885DRD1 26/4885
US-20030199499-A1 Novel guanidinobenzamides GUCY1B2, GPR119, GUCY1B1 METAP1 2959/4885DRD2 710/4885DRD1 1131/4885
US-20200039997-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 METAP1 4200/4885DRD2 46/4885DRD1 26/4885
US-20170008901-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 METAP1 4200/4885DRD2 46/4885DRD1 26/4885
US-20020137939-A1 Melanocortin-4 receptor (MC4-R) agonists; treating obesity or diabetes; 4-((N-cyclohexyl-3,5-dimethyl-piperazine-1-carboximidoyl)-amino)-N-(2-(2,4 -dichlorophenyl)-ethyl)-benzamide for example MC4R, MC5R, MC3R METAP1 717/4885DRD2 198/4885DRD1 230/4885
US-10479796-B2 Spiro-oxazolones AVPR1A, AVPR1B, AVPR2 METAP1 4200/4885DRD2 46/4885DRD1 26/4885

“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.