SCHEMBL6855320

SCHEMBL6855320

CCc1nc(C)c(CC)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 4/20 0.43
ADORA3 P0DMS8 3/20 0.43
ADORA2A P29274 2/20 0.43
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DDAH1 O94760 1/20 0.38
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
TNKS2 Q9H2K2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL25047048 0.88 L3MBTL1 (0.44) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL6003149 0.84 ADORA1 (0.39) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL3703117 0.84 PDK2 (0.40) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL3696311 0.84 GLA (0.38) ADORA1ADORA3ADORA2ATP53L3MBTL1
Hydrochloric Acid SCHEMBL11194272 0.82 ADORA1 (0.38) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL21095413 0.81 ALDH1A1 (0.39) TP53L3MBTL1SMN1; SMN2
SCHEMBL31531712 0.78 ALDH1A1 (0.41)
SCHEMBL9271915 0.78 TP53 (0.35) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL2849388 0.78 TP53 (0.35) ADORA1ADORA3ADORA2ATP53L3MBTL1
SCHEMBL2020536 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102464964-A Adhesive composition IND TECH RES INST 2012-05-23 CN claimed
CN-118076588-A Inclusion compound, epoxy resin curing agent, and curable resin composition 株式会社艾迪科 2024-05-24 CN disclosed
EP-3481878-B1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-05-22 EP disclosed
US-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors INCYTE CORPORATION (US) 2022-06-07 US disclosed
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN disclosed
WO-2021114553-A1 UNSATURATED POLYESTER RESIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF 广东盈骅新材料科技有限公司 2021-06-17 WO disclosed
US-11021561-B2 Amine composition useful for making polyurethane foam EVONIK OPERATIONS GMBH (DE) 2021-06-01 US disclosed
CN-110494469-A Thermosetting resin composition, cured film, band hardening ilm substrate, electronic component and ink for inkjet JNC CORP 2019-11-22 CN disclosed
CN-110408005-A Curable epoxy composition SABIC GLOBAL TECHNOLOGIES BV 2019-11-05 CN disclosed
CN-110099865-A Hexagonal boron nitride powder, method for producing same, resin composition, and resin sheet 昭和电工株式会社 2019-08-06 CN disclosed
CN-1213442-C Anisotropically conductive paste MITSUI CHEMICALS INC (JP) 2005-08-03 CN disclosed
CN-1175043-C Sealing material composition for liquid crystal 三井化学株式会社 2004-11-10 CN disclosed
US-20040149375-A1 Method for encapsulating a secondary battery SYNERGY SCIENTECH CORP. (TW) 2004-08-05 US disclosed
CN-1512616-A secondary battery packaging method 兴能高科技股份有限公司 2004-07-14 CN disclosed
CN-1310848-A Anisotropically conductive paste MITSUI CHEMICALS INC (JP) 2001-08-29 CN disclosed
CN-1310746-A Sealing material composition for liquid crystal MITSUI CHEMICALS INC (JP) 2001-08-29 CN disclosed
US-4529537-A Liquid epoxy resin hardeners and processes for their preparation BASF AKTIENGESELLSCHAFT (DE) 1985-07-16 US disclosed
US-4514556-A REACTION OF 2-ETHYL-4-METHYL IMIDAZOLE WITH CATALYST AND FORMALDEHYDE OR METHYLENIZING AGENT, CURING AGENT FOR EPOXY RESIN SHIKOKU CHEMICALS CORPORATION (JP) 1985-04-30 US disclosed
EP-0131842-A1 Liquid curing agents for epoxy resins, and process for their preparation BASF Aktiengesellschaft (DE) 1985-01-23 EP disclosed
EP-0126531-A2 4,4'-Methylene-bis-(2-ethyl-5-methyl imidazole) and methods of producing and using the same SHIKOKU CHEMICALS CORPORATION (JP) 1984-11-28 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 (1 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-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors PIK3CG, PIK3CD, PIK3CB ADORA1 1800/4885ADORA3 1264/4885ADORA2A 1457/4885

“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.