SCHEMBL6794355

SCHEMBL6794355

Nc1ccc(NCCc2ccccn2)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.51
HRH1 P35367 2/20 0.50
PKM P14618 3/20 0.48
HRH3 Q9Y5N1 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MAPT P10636 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
ALOX15 P16050 1/20 0.45
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43
APP P05067 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL6794552 0.84 PKM (0.55) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL6187553 0.83 CYP1A2 (0.51) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL6191755 0.80 PGK1 (0.54) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL4842263 0.79 MAOA (0.71) CYP1A2HRH1HRH3NPC1RAB9A
Hydrochloric Acid SCHEMBL4849352 0.79 RAB9A (0.54) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL6792582 0.78 PKM (0.47) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL6793640 0.78 ALDH1A1 (0.70) CYP1A2PKMNPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL4843995 0.78 MAOA (0.69) CYP1A2HRH1HRH3NPC1RAB9A
SCHEMBL7554683 0.77 CYP1A2 (0.50) CYP1A2HRH1PKMHRH3NPC1
SCHEMBL27583330 0.76 PKM (0.47) CYP1A2PKMHRH3NPC1RAB9A

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 CYP1A2 640/4885HRH1 2062/4885PKM 3447/4885

“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.