SCHEMBL4480052

SCHEMBL4480052

Cc1cncn1Cc1cccc(N)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.51
CYP11B2 P19099 6/20 0.51
CYP19A1 P11511 2/20 0.50
IDO1 P14902 2/20 0.41
ABHD6 Q9BV23 1/20 0.40
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
LMNA P02545 1/20 0.39
PLAU P00749 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL4833123 0.80 CYP11B1 (0.64) CYP11B1CYP11B2CYP19A1IDO1LMNA
SCHEMBL6496747 0.80 CYP11B1 (0.63) CYP11B1CYP11B2CYP19A1IDO1
SCHEMBL13604730 0.77 CYP11B1 (0.46) CYP11B1CYP11B2CYP19A1IDO1ALDH1A1
SCHEMBL13604331 0.74 MEN1 (0.55) CYP11B1CYP11B2CYP19A1MKNK1MKNK2
SCHEMBL28007108 0.73 CYP11B1 (0.59) CYP11B1CYP11B2CYP19A1LMNAALDH1A1
SCHEMBL15075172 0.73 CYP11B1 (0.68) CYP11B1CYP11B2CYP19A1IDO1LMNA
SCHEMBL4486484 0.72 CYP11B1 (0.51) CYP11B1CYP11B2LMNAPLAUALDH1A1
SCHEMBL3683547 0.72 CYP11B1 (0.44) CYP11B1CYP11B2CYP19A1ABHD6MAOA
SCHEMBL8652818 0.70 CYP11B1 (0.64) CYP11B1CYP11B2CYP19A1IDO1
SCHEMBL27745512 0.70 NR1H2 (0.51) CYP11B1CYP11B2CYP19A1IDO1ADORA2A

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-7635697-B2 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases SCHERING CORPORATION (US) 2009-12-22 US disclosed
US-7635697-B2 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases SCHERING CORPORATION (US) 2009-12-22 US disclosed
US-7635697-B2 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases SCHERING CORPORATION (US) 2009-12-22 US disclosed
EP-1833481-A1 FARNESYL PROTEIN TRANSFERASE INHIBITORS AND METHODS FOR TREATING PROLIFERATIVE DISEASES SCHERING CORPORATION (US) 2007-09-19 EP disclosed
US-20060211706-A1 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases SCHERING CORPORATION 2006-09-21 US disclosed
WO-2006065794-A1 FARNESYL PROTEIN TRANSFERASE INHIBITORS AND METHODS FOR TREATING PROLIFERATIVE DISEASES SCHERING CORPORATION (US) 2006-06-22 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-20060211706-A1 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases FNTB, FNTA, FDPS CYP11B1 320/4885CYP11B2 508/4885CYP19A1 1019/4885

“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.