SCHEMBL1004347

SCHEMBL1004347

c1ccc2nc(COc3cccc4ccccc34)ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 7/20 0.61
CYSLTR2 Q9NS75 3/20 0.61
PDE10A Q9Y233 1/20 0.52
GPBAR1 Q8TDU6 6/20 0.52
HTR1B P28222 1/20 0.49
KCNA3 P22001 1/20 0.49

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
SCHEMBL10512419 0.83 CYSLTR1 (0.56) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL9210004 0.82 CYSLTR1 (0.51) CYSLTR1CYSLTR2PDE10AGPBAR1HTR1B
SCHEMBL9081199 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL10689480 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL10662425 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL10683765 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL9843295 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL6582909 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL9363352 0.81 CYSLTR1 (0.61) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL6027036 0.80 PDE10A (0.59) CYSLTR1CYSLTR2PDE10AGPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3126004-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY DISORDERS Rogne Bioscience Inc. (US) 2017-02-08 EP claimed
WO-2015153838-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY DISORDERS ROGNE BIOSCIENCE INC. (US) 2015-10-08 WO claimed
EP-2453926-A2 PEPTIDES WHOSE UPTAKE IN CELLS IS CONTROLLABLE The Regents of the University of California (US) 2012-05-23 EP claimed
US-20110256130-A1 METHODS OF TREATING INFLAMMATORY DISORDERS SQUARE 1 BANK 2011-10-20 US claimed
WO-2011008996-A2 PEPTIDES WHOSE UPTAKE IN CELLS IS CONTROLLABLE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-01-20 WO claimed
US-20100183598-A1 METHODS OF TREATING CARDIOVASCULAR DISORDERS CAROLUS THERAPEUTICS, INC. (US) 2010-07-22 US claimed
WO-2010065491-A2 METHODS OF TREATING INFLAMMATORY DISORDERS CAROLUS THERAPEUTICS, INC. (US) 2010-06-10 WO claimed
WO-2010056910-A2 METHODS OF TREATING CARDIOVASCULAR DISORDERS CAROLUS THERAPEUTICS, INC. (US) 2010-05-20 WO claimed
EP-0223368-B1 SUBSTITUTED NAPHTHALENE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1989-12-27 EP claimed
US-4732978-A RESPIRATORY SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1988-03-22 US claimed
EP-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 EP claimed
US-20220347306-A1 SELECTIVE DELIVERY OF THERAPEUTIC AND IMAGING AGENTS AVELAS ACQUISITION CORPORATION 2022-11-03 US disclosed
US-20210079039-A1 COMPOSITIONS AND METHODS FOR THE SELECTIVE DELIVERY OF THERAPEUTIC AND IMAGING AGENTS AVELAS ACQUISITION CORPORATION 2021-03-18 US disclosed
EP-3781194-A1 COMPOSITIONS AND METHODS FOR THE SELECTIVE DELIVERY OF THERAPEUTIC AND IMAGING AGENTS Avelas Biosciences, Inc. (US) 2021-02-24 EP disclosed
EP-3755371-A1 COMBINATION CANCER THERAPY WITH ANTI-CANCER AGENTS AND ANTIBODIES TARGETING A COMPLEX COMPRISING NON-CLASSICAL HLA-I AND NEOANTIGEN Abexxa Biologics, Inc. (US) 2020-12-30 EP disclosed
US-6376528-B1 SYNERGISTIC MIXTURE G. D. SEARLE & CO. 2002-04-23 US disclosed
EP-0223368-B1 SUBSTITUTED NAPHTHALENE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1989-12-27 EP disclosed
US-4732978-A RESPIRATORY SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1988-03-22 US disclosed
US-4732978-A RESPIRATORY SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1988-03-22 US disclosed
EP-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 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 (4 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-20220347306-A1 SELECTIVE DELIVERY OF THERAPEUTIC AND IMAGING AGENTS PAICS, TIE1, ANTXR2 CYSLTR1 2792/4885CYSLTR2 2398/4885PDE10A 3058/4885
US-20110256130-A1 METHODS OF TREATING INFLAMMATORY DISORDERS TNF, MPO, MMP8 CYSLTR1 80/4885CYSLTR2 54/4885PDE10A 1281/4885
US-20100183598-A1 METHODS OF TREATING CARDIOVASCULAR DISORDERS TNNI3, TNNT2, FABP3 CYSLTR1 1203/4885CYSLTR2 1067/4885PDE10A 675/4885
US-20210079039-A1 COMPOSITIONS AND METHODS FOR THE SELECTIVE DELIVERY OF THERAPEUTIC AND IMAGING AGENTS PAICS, ANXA3, APOB CYSLTR1 3284/4885CYSLTR2 2965/4885PDE10A 1721/4885

“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.