SCHEMBL6798643

SCHEMBL6798643

O=C(Nc1ccc(NCCc2ccccn2)cc1)c1ccccc1-c1ccncc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
HTT P42858 4/20 0.51
LMNA P02545 2/20 0.51
SMO Q99835 2/20 0.49
CHRNB2 P17787 3/20 0.48
CHRNB4 P30926 3/20 0.48
CHRNA3 P32297 3/20 0.48
CHRNA4 P43681 3/20 0.48
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
KDR P35968 1/20 0.47
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CNR1 P21554 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
GLA P06280 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL6796673 0.93 HTT (0.59) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6791511 0.91 HTT (0.57) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6789227 0.90 LMNA (0.50) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6792583 0.90 KMT2A (0.56) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6788368 0.89 SMO (0.61) ALDH1A1HTTLMNASMOKDR
SCHEMBL6788981 0.89 HTT (0.49) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6794391 0.89 HTT (0.49) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6793707 0.89 CNR1 (0.58) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6793890 0.89 RAB9A (0.54) ALDH1A1HTTLMNASMOCHRNB2
SCHEMBL6787263 0.89 HTT (0.49) ALDH1A1HTTLMNASMOCHRNB2

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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 US disclosed
EP-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 ALDH1A1 1427/4885HTT 2566/4885LMNA 1239/4885

“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.