SCHEMBL6708558

SCHEMBL6708558

N#Cc1ccc(Cn2cncc2CN(CC2CCCCC2)c2ccc(N3CCNCC3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.46
FNTA P49354 8/20 0.44
FNTB P49356 8/20 0.44
PGGT1B P53609 6/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 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
SCHEMBL6714988 0.84 FNTA (0.53) KCNH2FNTAFNTBPGGT1BCYP11B1
SCHEMBL7255391 0.78 FNTA (0.48) KCNH2FNTAFNTBPGGT1BCYP11B1
SCHEMBL6708562 0.78 MAPKAPK2 (0.38) FNTAFNTBPGGT1B
SCHEMBL6708388 0.78 MAPKAPK2 (0.53)
SCHEMBL6708894 0.78 KCNH2 (0.46) KCNH2FNTAFNTBPGGT1BCYP11B1
SCHEMBL7255164 0.76 CYP11B1 (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL6710999 0.76 MAPKAPK2 (0.55)
SCHEMBL6711134 0.76 POLB (0.50) KCNH2FNTAFNTBPGGT1B
SCHEMBL7255055 0.75 CYP11B1 (0.42) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL6708602 0.74 CYP11B1 (0.52) KCNH2FNTAFNTBPGGT1BCYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092524-A1 Novel aminophenyl piperazine or aminophenyl piperidine derivatives inhibiting prenyl transferase proteins and method for preparing same PIERRE FABRE MEDICAMENT (FR) 2004-05-13 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-20040092524-A1 Novel aminophenyl piperazine or aminophenyl piperidine derivatives inhibiting prenyl transferase proteins and method for preparing same CBR3, CBR1, HCCS KCNH2 1919/4885FNTA 194/4885FNTB 48/4885

“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.