SCHEMBL8402804

SCHEMBL8402804

CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1c1ccc(OC)cc1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.70
MAPT P10636 4/20 0.70
SMN1; SMN2 Q16637 2/20 0.61
ABCG2 Q9UNQ0 8/20 0.58
ABCB1 P08183 6/20 0.58
KIF11 P52732 5/20 0.52
SIRT1 Q96EB6 1/20 0.52
LMNA P02545 2/20 0.51

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
SCHEMBL8402854 0.91 TP53 (0.86) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL765092 0.91 TP53 (0.68) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL8402811 0.91 TP53 (0.68) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL764584 0.90 TP53 (0.67) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL763553 0.90 TP53 (0.84) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL20704585 0.89 TP53 (0.66) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL20704712 0.89 TP53 (0.66) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL904374 0.89 TP53 (0.66) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL764121 0.89 TP53 (0.65) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL8402902 0.88 TP53 (0.65) TP53MAPTSMN1; SMN2ABCG2ABCB1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 TP53 854/4885MAPT 4518/4885SMN1; SMN2 4232/4885
US-20120129841-A1 CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 TP53 61/4885MAPT 4190/4885SMN1; SMN2 3554/4885
US-20090209521-A9 Inhibition of VEGF Translation EIF4E, EIF4EBP1, VEGFA TP53 854/4885MAPT 4518/4885SMN1; SMN2 4232/4885

“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.