SCHEMBL764223

SCHEMBL764223

COc1ccc(OC(=O)N2CCc3c([nH]c4ccc(Cl)cc34)C2c2cnc(N(C)C)nc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 9/20 0.53
ABCB1 P08183 7/20 0.53
TP53 P04637 3/20 0.53
MAPT P10636 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KIF11 P52732 7/20 0.49
SIRT1 Q96EB6 1/20 0.45

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
SCHEMBL16359404 1.00 ABCG2 (0.53) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL8403132 0.96 KIF11 (0.49) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL764051 0.90 TP53 (0.51) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL8403152 0.90 ABCG2 (0.55) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL8404438 0.89 ABCG2 (0.53) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL11912838 0.88 TP53 (0.53) ABCG2ABCB1TP53MAPTSMN1; SMN2
SCHEMBL11912707 0.88 TP53 (0.53) ABCG2ABCB1TP53MAPTSMN1; SMN2
Emvododstat SCHEMBL764056 0.87 TP53 (0.62) ABCG2ABCB1TP53MAPTSMN1; SMN2
Emvododstat SCHEMBL8509210 0.87 TP53 (0.62) ABCG2ABCB1TP53MAPTSMN1; SMN2
Emvododstat SCHEMBL9962251 0.87 TP53 (0.62) ABCG2ABCB1TP53MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS PTC THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS PTC THERAPEUTICS, INC. (US) 2013-07-04 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-20090209521-A9 Inhibition of VEGF Translation PTC THERAPEUTICS, INC. 2009-08-20 US disclosed
US-20090209521-A9 Inhibition of VEGF Translation PTC THERAPEUTICS, INC. 2009-08-20 US disclosed
WO-2008127714-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. (US) 2008-10-23 WO disclosed
US-20080064683-A1 Inhibition of VEGF Translation PTC THERAPEUTICS, INC. 2008-03-13 US disclosed
US-20080064683-A1 Inhibition of VEGF Translation PTC THERAPEUTICS, INC. 2008-03-13 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
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-20080064683-A1 Inhibition of VEGF Translation EIF4E, EIF4EBP1, VEGFA ABCG2 3060/4885ABCB1 1938/4885TP53 854/4885
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 ABCG2 3195/4885ABCB1 1109/4885TP53 52/4885
US-20120129841-A1 CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 ABCG2 3386/4885ABCB1 1360/4885TP53 61/4885
US-20090209521-A9 Inhibition of VEGF Translation EIF4E, EIF4EBP1, VEGFA ABCG2 3060/4885ABCB1 1938/4885TP53 854/4885
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS EIF2AK2, POLRMT, POLM ABCG2 4448/4885ABCB1 4335/4885TP53 156/4885
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 ABCG2 1872/4885ABCB1 2343/4885TP53 448/4885

“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.