SCHEMBL4967468

SCHEMBL4967468

Nc1nccn1CCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.50
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 1/20 0.46
HTR1A P08908 1/20 0.46
ARG1 P05089 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL11094158 0.83 HTR1A (0.47) MAPTRAB9ASMN1; SMN2HTR1A
SCHEMBL3040144 0.82 ALDH1A1 (0.53) MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL8443965 0.80 ESR1 (0.56) MAPTRAB9ASMN1; SMN2HSD17B10HTR1A
SCHEMBL8400794 0.78 CA12 (0.46) MAPTRAB9ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL8910934 0.77 ESR1 (0.56) MAPTRAB9ASMN1; SMN2HSD17B10HTR1A
SCHEMBL4351612 0.77 TDP1 (0.66) MAPTRAB9ASMN1; SMN2TDP1L3MBTL1
SCHEMBL6790333 0.73 TDP1 (0.71) MAPTRAB9ASMN1; SMN2TDP1L3MBTL1
SCHEMBL30567510 0.73 CREBBP (0.52) MAPTRAB9AHSD17B10ALDH1A1
SCHEMBL17219434 0.73 CREBBP (0.52) MAPTRAB9AHSD17B10ALDH1A1
SCHEMBL1680720 0.71 MAPT (0.56) MAPTRAB9ASMN1; SMN2TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973882-A1 PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS SCHERING CORPORATION (US) 2008-10-01 EP disclosed
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
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
WO-2007084498-A1 PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed
WO-2007084498-A1 PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed
US-6740661-B2 TRICYCLIC IMINE CONTAINING COMPOUNDS HAVING IMIDAZOLE SUBSTITUENT; ANTITUMOR AGENTS SCHERING CORPORATION 2004-05-25 US disclosed
US-20020103207-A1 Farnesyl protein transferase inhibitors TAVERAS ARTHUR G (US) 2002-08-01 US disclosed
US-6372747-B1 ENZYME INHIBITORS AND ANTICARCINOGENIC AGENTS SCHERING CORPORATION 2002-04-16 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 (2 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 TLR8 4872/4885MAPT 3135/4885RAB9A 496/4885
US-20020103207-A1 Farnesyl protein transferase inhibitors FNTB, FNTA, ACAT2 TLR8 4535/4885MAPT 3759/4885RAB9A 305/4885

“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.