SCHEMBL372572

SCHEMBL372572

O=C(O)C=Cc1ccc2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 1.00
KDM4E B2RXH2 6/20 1.00
MAPT P10636 5/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
HTT P42858 2/20 0.73
CYP1A2 P05177 1/20 0.73
CYP2C19 P33261 1/20 0.73
HDAC6 Q9UBN7 2/20 0.69
HDAC3 O15379 1/20 0.69
HDAC4 P56524 1/20 0.69
HDAC1 Q13547 1/20 0.69
HDAC7 Q8WUI4 1/20 0.69
HDAC2 Q92769 1/20 0.69
HDAC10 Q969S8 1/20 0.69
HDAC11 Q96DB2 1/20 0.69
HDAC8 Q9BY41 1/20 0.69
HDAC9 Q9UKV0 1/20 0.69
HDAC5 Q9UQL6 1/20 0.69
PFKFB3 Q16875 2/20 0.63
RAB9A P51151 4/20 0.61

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
SCHEMBL902324 1.00 LMNA (1.00) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL3532304 0.88 LMNA (0.79) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL3532302 0.88 LMNA (0.79) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL10309039 0.85 PFKFB3 (0.81) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL10275355 0.85 PFKFB3 (0.81) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL5717629 0.84 LMNA (0.73) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL6890723 0.84 LMNA (1.00) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL5717630 0.84 LMNA (0.73) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL6890727 0.84 LMNA (1.00) LMNAKDM4EMAPTSMN1; SMN2HTT
SCHEMBL30209642 0.84 LMNA (0.73) LMNAKDM4EMAPTSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114340374-B Sowing device and method for treating seeds during planting 先正达参股股份有限公司 2024-06-11 CN disclosed
EP-3632899-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RaQualia Pharma Inc. (JP) 2020-04-08 EP disclosed
US-10604536-B2 Substituted cyclopropanes as PDE-10 inhibitors Sunovion Pharamaceuticals Inc. (US) 2020-03-31 US disclosed
EP-2435407-B1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2019-12-25 EP disclosed
EP-2861596-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2019-03-20 EP disclosed
US-20180258104-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharamaceuticals Inc. 2018-09-13 US disclosed
US-9994590-B2 Substituted [1,2,4]triazolo[1,5-a]pyrazines as phosphodiesterase inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2018-06-12 US disclosed
US-20170037060-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2017-02-09 US disclosed
US-9522140-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2016-12-20 US disclosed
US-9505751-B2 Substituted [1,2,4]triazolo[1,5-a]pyrazines as phosphodiesterase inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2016-11-29 US disclosed
US-6417366-B2 CHEMICAL INTERMEDIATE FOR MACROLACTONE ANTIBIOTIC ABBOTT LABORATORIES 2002-07-09 US disclosed
US-20020072616-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy PFIZER INC. 2002-06-13 US disclosed
EP-1192139-A1 PREPARATION OF QUINOLINE-SUBSTITUTED CARBONATE AND CARBAMATE DERIVATIVES Abbott Laboratories (US) 2002-04-03 EP disclosed
US-20020013468-A1 Preparation of quinoline-substituted carbonate and carbamate derivatives ABBVIE INC. 2002-01-31 US disclosed
US-6313312-B1 OPIATE RECEPTOR BINDERS; ALLERGIC DERMATITIS, PRURITUS; IRRITABLE BOWEL SYNDROME, GASTROINTESTINAL AND SKIN DISORDERS; VETERINARY MEDICINE; ANTI-ITCHING PFIZER INC 2001-11-06 US disclosed
WO-2001000582-A1 PREPARATION OF QUINOLINE-SUBSTITUTED CARBONATE AND CARBAMATE DERIVATIVES ABBOTT LABORATORIES (US) 2001-01-04 WO disclosed
US-5334597-A Anti-asthmatic, antiallergic, antiinflammatory, cytoprotective treats angina, cerebral spasm, nephritis, hepatitis, uveitis, endotoxemia and allograft rejection MERCK FROSST CANADA, INC. (CA) 1994-08-02 US disclosed
EP-0538000-A1 Indole and indazole carbamates as leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1993-04-21 EP disclosed
US-5039684-A Absorption when administered orally VALEAS S. P. A. (IT) 1991-08-13 US disclosed
EP-0384450-A1 Tetrazole amide derivatives of heterocyclic alkenyl acids and their use as antiallergic substances VALEAS S.p.A. INDUSTRIA CHIMICA E FARMACEUTICA (IT) 1990-08-29 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 (5 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-20020072616-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy OPRM1, OPRK1, OPRD1 LMNA 3931/4885KDM4E 3058/4885MAPT 2546/4885
US-20170037060-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN LMNA 2445/4885KDM4E 969/4885MAPT 778/4885
US-20180258104-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN LMNA 2445/4885KDM4E 969/4885MAPT 778/4885
US-10604536-B2 Substituted cyclopropanes as PDE-10 inhibitors PDE10A, PDE2A, PDE3A LMNA 4079/4885KDM4E 1418/4885MAPT 1006/4885
US-20020013468-A1 Preparation of quinoline-substituted carbonate and carbamate derivatives CA7, CA6, CA4 LMNA 2600/4885KDM4E 211/4885MAPT 3625/4885

“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.