SCHEMBL251101

SCHEMBL251101

CCCCCC1=NCCO1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.32
ADRA2B P18089 3/20 0.32
ADRA2C P18825 3/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.31
CYP1A2 P05177 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7056733 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7060405 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7061452 0.98 KCNH2 (0.34) KCNH2
SCHEMBL961102 0.98 KCNH2 (0.34) KCNH2
SCHEMBL8337997 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7058385 0.98 KCNH2 (0.34) KCNH2
SCHEMBL2493950 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7206068 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7056094 0.98 KCNH2 (0.34) KCNH2
SCHEMBL7054565 0.98 KCNH2 (0.34) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118140318-A Negative electrode aqueous slurry composition for lithium ion electric storage device PPG工业俄亥俄公司 2024-06-04 CN claimed
CN-115108987-B N-substituted indenoisoquinolinone derivative and preparation method thereof 华侨大学 2023-05-26 CN claimed
EP-3236936-B1 AMPHIPHILIC POLYMER SYSTEMS UNIV BASEL (CH) 2020-02-19 EP claimed
EP-3442501-A1 COMPOSITIONS AND METHODS FOR MAINTAINING OR ENHANCING HOMEOSTASIS OR FUNCTION OF FEMALE LOWER REPRODUCTIVE TRACT Fairhaven Health, LLC (US) 2019-02-20 EP claimed
EP-2641927-B1 Thermosensitive copolymers, and forward osmosis water treatment devices and methods of using the same SAMSUNG ELECTRONICS CO LTD (KR) 2018-10-17 EP claimed
CN-107567330-A Amphipathic nature polyalcohol system 巴塞尔大学医院 2018-01-09 CN claimed
US-20170369655-A1 AMPHIPHILIC POLYMER SYSTEMS UNIVERSITÄTSSPITAL BASEL (CH) 2017-12-28 US claimed
EP-3236936-A1 AMPHIPHILIC POLYMER SYSTEMS Universitätsspital Basel (CH) 2017-11-01 EP claimed
WO-2017180174-A1 COMPOSITIONS AND METHODS FOR MAINTAINING OR ENHANCING HOMEOSTASIS OR FUNCTION OF FEMALE LOWER REPRODUCTIVE TRACT FAIRHAVEN HEALTH, LLC (US) 2017-10-19 WO claimed
CN-105001175-B A kind of preparation method of 2 aryl 2 oxazoline 安阳师范学院 2017-03-01 CN claimed
US-6440942-B1 MODIFICATIONS TO ENHANCE ACID STABILITY AND PREVENT ANHYDRO FORMATION; ROXITHROMYCIN AND CLARITHROMYCIN; ACTIVE AGAINST MLS-RESISTANT STRAINS (MLS=MACROLIDES-LINCOSAMIDES-STREPTOGRAMINES) ENANTA PHARMACEUTICALS, INC. 2002-08-27 US claimed
US-6436906-B1 NOVEL MACROLIDES HAVING ANTIBACTERIAL ACTIVITY TOWARD GRAMPOSITIVE AND GRAMNEGATIVE BACTERIA AS WELL AS MACROLIDE RESISTANT GRAMPOSITIVES ENANTA PHARMACEUTICALS, INC. 2002-08-20 US claimed
WO-2002060912-A1 14-MEMBERED MACROLIDES DERIVED FROM LEUCOMYCINS ENANTA PHARMACEUTICALS, INC. (US) 2002-08-08 WO claimed
US-20020016355-A1 Synthesis of clasto-lactacystin beta-lactone and analogs thereof SOUCY FRANCOIS (US) 2002-02-07 US claimed
EP-1021407-A4 SYNTHESIS OF CLASTO-LACTACYSTIN BETA-LACTONE AND ANALOGS THEREOF MILLENNIUM PHARM INC (US) 2001-07-04 EP claimed
EP-1021407-A1 SYNTHESIS OF CLASTO-LACTACYSTIN BETA-LACTONE AND ANALOGS THEREOF Millennium Pharmaceuticals, Inc. (US) 2000-07-26 EP claimed
WO-1999009006-A1 SYNTHESIS OF CLASTO-LACTACYSTIN β-LACTONE AND ANALOGS THEREOF SOUCY FRANCOIS (US) 1999-02-25 WO claimed
EP-0468470-B1 Benzimidazoles, medicaments containing them and process for their preparation THOMAE GMBH DR K (DE) 1997-04-16 EP claimed
WO-1992011243-A1 1-MONO OR 1,3-BIS-SUBSTITUTED IMIDAZOLIUM SALTS AND THEIR BENZO ANALOGUES, PROCESS FOR MANUFACTURE AND THEIR USE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1992-07-09 WO claimed
US-4016192-A Unsaturated acrylic acid-oxazoline reaction products THE DOW CHEMICAL COMPANY (US) 1977-04-05 US claimed

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-20020016355-A1 Synthesis of clasto-lactacystin beta-lactone and analogs thereof PSMB7, PSMB5, LTN1 ADRA2A 4413/4885ADRA2B 3956/4885ADRA2C 4233/4885
US-20170369655-A1 AMPHIPHILIC POLYMER SYSTEMS ANAPC7, ANXA7, PAICS ADRA2A 1043/4885ADRA2B 1219/4885ADRA2C 959/4885

“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.