SCHEMBL3210469

SCHEMBL3210469

CC(=O)N1CCc2ccccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 1.00
KMT2A Q03164 3/20 0.66
MAPT P10636 2/20 0.66
TAAR1 Q96RJ0 2/20 0.66
MEN1 O00255 1/20 0.66
ALDH1A1 P00352 4/20 0.61
HPGD P15428 2/20 0.61
HTT P42858 2/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
ALOX15 P16050 1/20 0.59
HSD17B10 Q99714 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.58
RAB9A P51151 3/20 0.58
NPC1 O15118 2/20 0.58
TP53 P04637 1/20 0.58
ACE P12821 2/20 0.58
HRH3 Q9Y5N1 1/20 0.58
TMPRSS2 O15393 1/20 0.58

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
SCHEMBL30539318 1.00 NOTUM (1.00) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL249471 0.90 NOTUM (0.81) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL7227468 0.89 NOTUM (0.80) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL1197829 0.86 NOTUM (1.00) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL27901981 0.84 NOTUM (0.72) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL322928 0.82 NOTUM (0.70) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL4290743 0.82 NOTUM (0.70) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL16281586 0.82 NOTUM (0.70) NOTUMKMT2AMAPTTAAR1MEN1
SCHEMBL20752768 0.82 NOTUM (0.67) NOTUMKMT2AMEN1ALDH1A1HPGD
SCHEMBL18689693 0.81 NOTUM (0.68) NOTUMKMT2AMAPTTAAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2892892-A1 IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR!THE TREATMENT OF CANCER Janssen Pharmaceutica N.V. (BE) 2015-07-15 EP claimed
WO-2014039769-A1 IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR|THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2014-03-13 WO claimed
EP-0245960-B1 PROCESS FOR PREPARING N-ACYLTETRAHYDROISOQUINOLINE Takasago Perfumery Co., Ltd. (JP) 1992-07-29 EP claimed
EP-4328219-A1 SOS1 DEGRADING AGENT AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Leadingtac Pharmaceutical Co. Ltd. (CN) 2024-02-28 EP disclosed
EP-3356345-B1 HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-11-08 EP disclosed
US-11724992-B2 Compounds and compositions for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2023-08-15 US disclosed
EP-3724188-B1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME ARKUDA THERAPEUTICS (US) 2023-06-07 EP disclosed
WO-2023076219-A2 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA, INC. (US) 2023-05-04 WO disclosed
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 US disclosed
EP-3444238-B1 PROCESS FOR PREPARING DIFLUOROMETHYLENE COMPOUNDS SATO PHARMA (JP) 2021-12-08 EP disclosed
WO-2021222858-A1 ANTAGONISTS OF GPR39 PROTEIN OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-11-04 WO disclosed
EP-0076559-A1 Antiallergic imidosulfamides SMITHKLINE BECKMAN CORPORATION (US) 1983-04-13 EP disclosed
EP-0074741-A1 Method of producing alpha2 antagonism SMITHKLINE BECKMAN CORPORATION (US) 1983-03-23 EP disclosed
US-4352809-A THIADIAZOLO- AND OXADIAZOLOTETRAHYDROISOQUINOLINES, ANTIDEPRESSANTS SMITHKLINE CORPORATION (US) 1982-10-05 US disclosed
US-4350698-A ASTHMA SMITHKLINE CORPORATION (US) 1982-09-21 US disclosed
US-4315935-A INHIBITING THE SYMPTOMS OF ASTHMA SMITHKLINE CORPORATION (US) 1982-02-16 US disclosed
EP-0038177-A1 Antiallergic imidodisulfamides, pharmaceutical compositions containing them and process for their preparation SMITHKLINE BECKMAN CORPORATION (US) 1981-10-21 EP disclosed
US-4258049-A Inhibiting phenylethanolamine N-methyltransferase with thiadiazolo and oxadiazolotetrahydroisoquinolines SMITHKLINE CORPORATION (US) 1981-03-24 US disclosed
EP-0023761-A1 Tetrahydroisoquinoline derivatives, process for preparing them and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1981-02-11 EP disclosed
US-4228170-A INHIBITOR OF PHENYLETHANOLAMINE N-METHYLTRANSFERASE SMITHKLINE CORPORATION (US) 1980-10-14 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-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 NOTUM 4102/4885KMT2A 968/4885MAPT 458/4885
US-11724992-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 NOTUM 2896/4885KMT2A 4441/4885MAPT 2020/4885

“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.