SCHEMBL765005

SCHEMBL765005

ONCCc1c[nH]c2ccc(Br)cc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.68
MTNR1B P49286 1/20 0.68
HTR2A P28223 4/20 0.65
TRPM8 Q7Z2W7 1/20 0.65
GPR84 Q9NQS5 1/20 0.63
SLC6A4 P31645 4/20 0.57
MPO P05164 1/20 0.57
CHRNB2 P17787 1/20 0.56
CHRNA7 P36544 1/20 0.56
CHRNA4 P43681 1/20 0.56
HTR1A P08908 3/20 0.56
CSNK2A1 P68400 1/20 0.55
HTR2C P28335 2/20 0.53
ADRA2A P08913 1/20 0.53
DRD2 P14416 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
SLC6A2 P23975 1/20 0.53
ADRA1D P25100 1/20 0.53
HTR1D P28221 1/20 0.53

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
SCHEMBL5430044 0.85 HTR2A (0.80) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL10648384 0.84 CHRNB2 (0.78) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL27788551 0.83 HTR2C (0.75) HTR2ASLC6A4MPOHTR1AHTR2C
SCHEMBL11080741 0.82 MTNR1A (0.78) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL29444443 0.82 HTR2A (0.71) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL733712 0.82 HTR2A (0.71) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL6919750 0.81 MTNR1A (1.00) MTNR1AMTNR1BMPOHTR1AHTR2B
SCHEMBL5149801 0.81 MTNR1A (0.70) MTNR1AMTNR1BHTR2ASLC6A4MPO
SCHEMBL2406261 0.80 MTNR1A (0.60) MTNR1AMTNR1BHTR2ATRPM8GPR84
SCHEMBL6640808 0.80 HTR2A (0.73) MTNR1AMTNR1BHTR2ATRPM8GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130289083-A1 IDO Inhibitors NEWLINK GENETICS CORPORATION 2013-10-31 US disclosed
US-8372860-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-12 US disclosed
US-8372860-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-12 US disclosed
US-8367694-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-05 US disclosed
US-8367694-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-05 US disclosed
EP-1737461-B1 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS PTC THERAPEUTICS INC (US) 2012-12-12 EP disclosed
US-20120129841-A1 CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2012-05-24 US disclosed
US-20120129841-A1 CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2012-05-24 US disclosed
EP-2431369-A2 Carboline derivatives useful in the inhibition of angiogenesis PTC Therapeutics, Inc. (US) 2012-03-21 EP disclosed
US-8076352-B2 Administration of carboline derivatives useful in the treatment of cancer and other diseases PTC THERAPEUTICS, INC. (US) 2011-12-13 US disclosed
US-7601840-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2009-10-13 US disclosed
US-7601840-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2009-10-13 US disclosed
US-20090227618-A2 Carboline Derivatives Useful in the Inhibition of Angiogenesis PTC THERAPEUTICS, INC. (US) 2009-09-10 US disclosed
US-20090227618-A2 Carboline Derivatives Useful in the Inhibition of Angiogenesis PTC THERAPEUTICS, INC. (US) 2009-09-10 US disclosed
US-20090227574-A2 Administration of Carboline Derivatives Useful in the Treatment of Cancer and Other Diseases PTC THERAPEUTICS, INC. (US) 2009-09-10 US disclosed
US-20090227574-A2 Administration of Carboline Derivatives Useful in the Treatment of Cancer and Other Diseases PTC THERAPEUTICS, INC. (US) 2009-09-10 US disclosed
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration PCT THERAPEUTICS, INC. (US) 2007-12-06 US disclosed
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration PCT THERAPEUTICS, INC. (US) 2007-12-06 US disclosed
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2007-11-01 US disclosed
WO-2005089764-A9 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS PTC THERAPEUTICS INC (US) 2007-09-13 WO 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 (6 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-20090227574-A2 Administration of Carboline Derivatives Useful in the Treatment of Cancer and Other Diseases VEGFA, FLT4, FLT1 MTNR1A 398/4885MTNR1B 477/4885HTR2A 1527/4885
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 MTNR1A 398/4885MTNR1B 477/4885HTR2A 1527/4885
US-20120129841-A1 CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 MTNR1A 611/4885MTNR1B 644/4885HTR2A 1837/4885
US-20090227618-A2 Carboline Derivatives Useful in the Inhibition of Angiogenesis VEGFA, FLT4, KDR MTNR1A 236/4885MTNR1B 129/4885HTR2A 2036/4885
US-20130289083-A1 IDO Inhibitors IDO1, IDO2, INMT MTNR1A 404/4885MTNR1B 479/4885HTR2A 243/4885
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration VEGFA, FLT4, MIF MTNR1A 80/4885MTNR1B 40/4885HTR2A 824/4885

“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.