SCHEMBL6079992

SCHEMBL6079992

Nc1cc(CO)ccc1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
HPGD P15428 1/20 0.49
MAPT P10636 2/20 0.48
TP53 P04637 1/20 0.48
XBP1 P17861 1/20 0.48
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
TSHR P16473 1/20 0.47
FOLH1 Q04609 1/20 0.47
TTR P02766 1/20 0.46
LTA4H P09960 1/20 0.46
MAPK14 Q16539 1/20 0.46
FFAR4 Q5NUL3 1/20 0.44
FFAR1 O14842 1/20 0.44
MAOB P27338 1/20 0.44
LIPE Q05469 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
SCHEMBL8021977 0.85 TTR (0.54) SMN1; SMN2RAB9AMAPTTSHRTTR
SCHEMBL584781 0.84 SLC2A1 (0.56) SMN1; SMN2RAB9ANPC1HPGDMAPT
SCHEMBL30280404 0.84 SLC2A1 (0.56) SMN1; SMN2RAB9ANPC1HPGDMAPT
SCHEMBL30279504 0.83 PTGER1 (0.46) APPSMN1; SMN2RAB9ANPC1HPGD
SCHEMBL8057639 0.83 LMNA (0.52) APPSMN1; SMN2RAB9AHPGDMAPT
SCHEMBL10409146 0.82 APP (0.49) APPSMN1; SMN2RAB9AMAPTLTA4H
SCHEMBL1989845 0.81 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ANPC1HPGDMAPT
SCHEMBL11372714 0.81 MAPT (0.56) APPSMN1; SMN2RAB9AMAPTTP53
SCHEMBL6511865 0.81 APP (0.47) APPSMN1; SMN2RAB9AMAPTFOLH1
SCHEMBL5783643 0.81 APP (0.47) APPSMN1; SMN2RAB9ANPC1MAPT

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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US disclosed
EP-1451159-A1 COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF NEURO3D (FR) 2004-09-01 EP disclosed
WO-2003010146-A1 COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF NEURO3D (FR) 2003-02-06 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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL APP 442/4885SMN1; SMN2 2666/4885RAB9A 431/4885

“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.