SCHEMBL8445337

SCHEMBL8445337

N#Cc1ccc(N(Cc2ccc(I)cc2)n2cnnc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 20/20 0.76
STS P08842 2/20 0.63

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
SCHEMBL8446302 0.93 CYP19A1 (0.86) CYP19A1STS
SCHEMBL12189187 0.89 CYP19A1 (0.76) CYP19A1STS
SCHEMBL2700646 0.86 CYP19A1 (0.76) CYP19A1STS
SCHEMBL2702534 0.86 CYP19A1 (0.76) CYP19A1STS
SCHEMBL544997 0.86 CYP19A1 (1.00) CYP19A1STS
SCHEMBL8446035 0.86 CYP19A1 (0.76) CYP19A1STS
SCHEMBL8445354 0.86 CYP19A1 (1.00) CYP19A1STS
SCHEMBL3233064 0.86 CYP19A1 (1.00) CYP19A1
SCHEMBL5035869 0.86 CYP19A1 (0.76) CYP19A1STS
SCHEMBL8445536 0.86 CYP19A1 (0.76) CYP19A1STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120230914-A1 LABELING COMPOUND FOR PET RIKEN (JP) 2012-09-13 US disclosed
EP-0641785-B1 TRIAZOLYLATED TERTIARY AMINE COMPOUND OR SALT THEREOF YAMANOUCHI PHARMA CO LTD (JP) 1999-10-27 EP disclosed
US-5674886-A AROMATASE INHIBITOR; BREAST CANCER; UROGENITAL DISORDERS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-10-07 US disclosed
EP-0641785-A1 TRIAZOLYLATED TERTIARY AMINE COMPOUND OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1995-03-08 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-20120230914-A1 LABELING COMPOUND FOR PET CYP19A1, CYP2F1, CYP4F11 CYP19A1 1/4885STS 666/4885

“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.