SCHEMBL1994985

SCHEMBL1994985

Nc1ccc(CC[O])cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.68
MAOB P27338 4/20 0.56
MAOA P21397 2/20 0.56
ALDH1A1 P00352 1/20 0.52
CYP3A4 P08684 1/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RECQL P46063 1/20 0.52
LOXL2 Q9Y4K0 1/20 0.50
CYP19A1 P11511 5/20 0.48
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
CHKA P35790 1/20 0.41
FDPS P14324 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40

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
SCHEMBL10540891 0.85 GFER (0.42) GFERMAOBMAOAALDH1A1CA12
SCHEMBL8866936 0.84 GFER (0.62) GFERMAOBMAOAALDH1A1CYP3A4
SCHEMBL8164156 0.82 GFER (1.00) GFERMAOBMAOAALDH1A1CYP3A4
SCHEMBL187043 0.82 GFER (1.00) GFERMAOBMAOAALDH1A1CYP3A4
SCHEMBL3482833 0.82 GFER (1.00) GFERMAOBMAOAALDH1A1CYP3A4
SCHEMBL8866768 0.80 RAB9A (0.68) GFERTDP1MEN1MAPTKMT2A
SCHEMBL14048182 0.80 GFER (0.72) GFERMAOBMAOAALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL8653872 0.79 GFER (0.93) GFERMAOBMAOAALDH1A1CYP3A4
SCHEMBL8867927 0.78 HRH3 (0.52) LOXL2MAPTCA12CA1CA2
SCHEMBL12110702 0.77 GFER (0.77) GFERMAOBMAOAALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5955601-A USEFUL IN NUCLEIC ACID HYBRIDIZATION ASSAYS AND FOR GENERATING LABELLED PROBES; UNUSUALLY HIGH EFFICIENCY OF RARE EARTH ELEMENT CAPTURE CORRELATED WITH EMISSION OF A HIGH LEVEL OF SIGNAL IN TIME-RESOLVED FLUORESCENCE SPECTROSCOPY E G & G WALLAC (FI) 1999-09-21 US claimed
EP-0525181-B1 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES DADE MICROSCAN INC (US) 1997-08-06 EP claimed
EP-0525181-A4 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES 1993-03-10 EP claimed
EP-0525181-A1 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES. BAXTER DIAGNOSTICS INC (US) 1993-02-03 EP claimed
WO-1992014841-A1 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES BAXTER DIAGNOSTICS INC. (US) 1992-09-03 WO claimed
EP-2338886-A2 Naphthalene derivatives Novartis AG (CH) 2011-06-29 EP disclosed
US-7045533-B2 Such as naphthalen-1-yl-(4-pentyloxy-naphthalen-1-yl)-mehtane for treatment/prevention of diseases/conditions associated with cannobinoid receptor activation such as chronic pain, osteo- and rheumatoid arthritis, teno-synovitis and gout NOVARTIS AG (CH) 2006-05-16 US disclosed
WO-2005058292-A1 NEW USE IN GASTROINTESTINAL DISORDERS ASTRAZENECA AB (SE) 2005-06-30 WO disclosed
US-20040053890-A1 Naphthalene derivatives NOVARTIS AG (CH) 2004-03-18 US disclosed
EP-1339663-A2 NAPHTHALENE DERIVATIVES Novartis AG (CH) 2003-09-03 EP disclosed
WO-2002042248-A2 NAPHTHALENE DERIVATIVES NOVARTIS AG (CH) 2002-05-30 WO disclosed
US-5955601-A USEFUL IN NUCLEIC ACID HYBRIDIZATION ASSAYS AND FOR GENERATING LABELLED PROBES; UNUSUALLY HIGH EFFICIENCY OF RARE EARTH ELEMENT CAPTURE CORRELATED WITH EMISSION OF A HIGH LEVEL OF SIGNAL IN TIME-RESOLVED FLUORESCENCE SPECTROSCOPY E G & G WALLAC (FI) 1999-09-21 US disclosed
EP-0232623-B1 1-CARBACEPHALOSPORIN ANTIBIOTICS ELI LILLY AND COMPANY (US) 1993-03-17 EP disclosed
EP-0525181-A4 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES 1993-03-10 EP disclosed
EP-0525181-A1 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES. BAXTER DIAGNOSTICS INC (US) 1993-02-03 EP disclosed
WO-1992014841-A1 NOVEL LANTHANIDE CHELATE-CONJUGATED OLIGONUCLEOTIDES BAXTER DIAGNOSTICS INC. (US) 1992-09-03 WO disclosed
US-4892942-A 1-CARBA (DETHIA)CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1990-01-09 US disclosed
US-4791106-A 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1988-12-13 US disclosed
EP-0232623-A1 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1987-08-19 EP disclosed
US-4332809-A ANTIALLERGENS TANABE SEIYAKU CO., LTD. (JP) 1982-06-01 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 (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-20040053890-A1 Naphthalene derivatives CYP1A1, SULT1E1, CYP2F1 GFER 3130/4885MAOB 856/4885MAOA 1144/4885

“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.