SCHEMBL7677950

SCHEMBL7677950

N#Cc1ccc(C(c2c[nH]cn2)C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
S1PR3 Q99500 14/20 0.36
S1PR1 P21453 7/20 0.36
S1PR4 O95977 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
EP300 Q09472 3/20 0.33

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
SCHEMBL8149150 0.90 NR3C1 (0.35) S1PR3S1PR1
SCHEMBL8155413 0.85 ALDH1A1 (0.36)
SCHEMBL8155536 0.84 IMPDH2 (0.36) S1PR3S1PR1
SCHEMBL8157364 0.83 XDH (0.36)
SCHEMBL8150877 0.82 CYP2D6 (0.35) S1PR3S1PR1
SCHEMBL5891827 0.81 CYP19A1 (0.36)
SCHEMBL7669882 0.80 VNN1 (0.35)
SCHEMBL7663652 0.74
SCHEMBL7668534 0.72 ALDH1A1 (0.34)
SCHEMBL7675183 0.71 KIF11 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease MERCK & CO., INC. 2002-03-28 US disclosed
US-6284755-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-09-04 US disclosed
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 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 (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-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease FNTA, PKD1, FNTB CYP11B1 3154/4885CYP11B2 3807/4885S1PR3 1349/4885

“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.