SCHEMBL6709635

SCHEMBL6709635

S=C(NC1CCCCC1)N1CCN(c2ccc(NCc3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
HTT P42858 6/20 0.48
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
ALOX12 P18054 2/20 0.48
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GAA P10253 2/20 0.43
MAPK1 P28482 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NPY2R P49146 2/20 0.41
PKM P14618 1/20 0.39

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
SCHEMBL6711176 0.82 LMNA (0.42) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL6714778 0.77 KDM1A (0.41) MAPTALOX12ALDH1A1GAAMAPK1
SCHEMBL6711285 0.75 MAPT (0.53) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL6715174 0.74 MAPT (0.54) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL6711131 0.74 MAPT (0.41) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL6710775 0.71 MAPT (0.54) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL6709631 0.69 MAPT (0.47) MAPTHTTLMNASMN1; SMN2ALOX12
SCHEMBL8644544 0.68 CYP3A4 (0.43) GAA
SCHEMBL7838272 0.65 SIRT2 (0.41)
SCHEMBL9239498 0.62 SIRT2 (0.43) MAPTHTTLMNASMN1; SMN2MEN1

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 MAPT 4753/4885HTT 4421/4885LMNA 2447/4885

“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.