SCHEMBL985863

SCHEMBL985863

COc1ccc2c(c1)CCN(C=O)C2c1cc(Cl)cc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 11/20 0.55
CA2 P00918 11/20 0.55
CA9 Q16790 11/20 0.55
CA14 Q9ULX7 11/20 0.55
DRD1 P21728 3/20 0.49
CA7 P43166 1/20 0.47
TAS2R14 Q9NYV8 1/20 0.42
PDE4D Q08499 2/20 0.42
GRIN2C Q14957 1/20 0.41
DRD2 P14416 1/20 0.41

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
SCHEMBL986105 0.89 DRD1 (0.52) CA1CA2CA9CA14DRD1
SCHEMBL988054 0.88 CA1 (0.50) CA1CA2CA9CA14DRD1
SCHEMBL987586 0.87 CA1 (0.49) CA1CA2CA9CA14CA7
SCHEMBL986126 0.86 CA1 (0.55) CA1CA2CA9CA14DRD1
SCHEMBL983323 0.85 CA1 (0.47) CA1CA2CA9CA14DRD1
SCHEMBL985708 0.85 DRD1 (0.48) CA1CA2CA9CA14DRD1
SCHEMBL4669747 0.83 CA1 (0.56) CA1CA2CA9CA14DRD1
SCHEMBL985273 0.81 CA1 (0.49) CA1CA2CA9CA14DRD1
SCHEMBL985641 0.80 CA1 (0.54) CA1CA2CA9CA14DRD1
SCHEMBL987287 0.79 CA1 (0.52) CA1CA2CA9CA14DRD1

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-7875631-B2 e.g.1-(3,5-dichlorophenyl)-2-formyl-6-methoxy-1,2,3,4-tetrahydroisoquinoline; to prevent and/or treat cancer and other abnormal cell growth, and metabolic as well as blood vessel proliferate disorders, in which uncontrolled expression of insulin-like growth factor-1 receptor is observed ANALYTECON S.A. (CH) 2011-01-25 US claimed
EP-1732898-B1 TETRAHYDROISOQUINOLINE- AND TETRAHYDROBENZAZEPINE DERIVATIVES AS IGF-1R INHIBITORS ANALYTECON SA (CH) 2008-01-23 EP claimed
US-20070129399-A1 Tetrahydroisoquinoline-and tetrahydrobenzazepine derivatives as igf-1r inhibitors ANALYTECON S.A. (CH) 2007-06-07 US claimed
EP-1732898-A1 TETRAHYDROISOQUINOLINE- AND TETRAHYDROBENZAZEPINE DERIVATIVES AS IGF-1R INHIBITORS Analytecon S.A. (CH) 2006-12-20 EP claimed
WO-2005087743-A1 TETRAHYDROISOQUINOLINE-AND TETRAHYDROBENZAZEPINE DERIVATIVES AS IGF-1R INHIBITORS ANALYTECON S.A. (CH) 2005-09-22 WO claimed
EP-1732898-B1 TETRAHYDROISOQUINOLINE- AND TETRAHYDROBENZAZEPINE DERIVATIVES AS IGF-1R INHIBITORS ANALYTECON SA (CH) 2008-01-23 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 (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-20070129399-A1 Tetrahydroisoquinoline-and tetrahydrobenzazepine derivatives as igf-1r inhibitors IGF1R, INSR, GPR119 CA1 3524/4885CA2 3861/4885CA9 4686/4885

“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.