SCHEMBL14415966

SCHEMBL14415966

CC(CC#N)n1ccnc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.41
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 2/20 0.38
CYP17A1 P05093 5/20 0.37
CYP26A1 O43174 1/20 0.35

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
Water SCHEMBL28822856 0.78 CYP17A1 (0.44) CYP19A1KDM4EKMT2ACYP17A1
SCHEMBL185527 0.78
SCHEMBL29331378 0.77 KDM4E (0.45) CYP19A1KDM4EKMT2ACYP17A1CYP26A1
SCHEMBL10782690 0.77 KDM4E (0.42) KDM4EKMT2ACYP26A1
SCHEMBL14317920 0.75
SCHEMBL408049 0.75
SCHEMBL10015535 0.75
Water SCHEMBL28065165 0.74 CYP17A1 (0.46) CYP19A1KDM4EKMT2ACYP17A1
Bromide SCHEMBL25395862 0.74 CYP17A1 (0.44) CYP19A1KDM4EKMT2ACYP17A1
Iodide SCHEMBL20816028 0.74 CYP17A1 (0.44) CYP19A1KDM4EKMT2ACYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 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 (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-20070213340-A1 Farnesyl protein transferase inhibitors FNTB, FNTA, FDPS CYP19A1 1629/4885KDM4E 2390/4885KMT2A 3516/4885

“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.