SCHEMBL6378358

SCHEMBL6378358

Fc1ccccc1C[N]Cc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.44
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LIN28A Q9H9Z2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PKM P14618 1/20 0.38
CHRNA7 P36544 1/20 0.38

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
SCHEMBL1043027 0.82 HRH1 (0.54) HRH1ALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL9953712 0.79 L3MBTL1 (0.50) HRH1ALDH1A1RAB9ANPC1HTT
SCHEMBL3132125 0.73 HRH3 (0.46) HRH1ALDH1A1MAPTSMN1; SMN2LIN28A
SCHEMBL3626562 0.73 CYP1A2 (0.46) HRH1ALDH1A1L3MBTL1POLBMAPT
SCHEMBL21985094 0.72 HRH1 (0.52) HRH1ALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL10630168 0.69 HRH1 (0.41) HRH1ALDH1A1RAB9ANPC1L3MBTL1
SCHEMBL8519867 0.69 HRH1 (0.41) HRH1ALDH1A1RAB9ANPC1L3MBTL1
SCHEMBL1140168 0.69
SCHEMBL31613157 0.69
SCHEMBL11787969 0.69

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-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-06-09 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-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1B, ADRB2 HRH1 191/4885ALDH1A1 318/4885RAB9A 792/4885

“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.