SCHEMBL6486252

SCHEMBL6486252

O=C(NC1CC2CNC1C2)c1ccc(-c2ccccc2O)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.41
NPC1 O15118 4/20 0.41
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
GAA P10253 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 5/20 0.38
HPGD P15428 4/20 0.38
MAPT P10636 2/20 0.38
HSD17B1 P14061 1/20 0.38
KDM4E B2RXH2 4/20 0.36
TDP1 Q9NUW8 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPK1 P28482 2/20 0.36
CASP3 P42574 1/20 0.36
RECQL P46063 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
HSD17B10 Q99714 2/20 0.35

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
SCHEMBL6495236 0.88 RAB9A (0.49) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6489007 0.88 SLC9A1 (0.44) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6496767 0.88 ALDH1A1 (0.49) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6488527 0.88 RAB9A (0.55) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6487086 0.87 ALDH1A1 (0.51) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6488167 0.85 S1PR4 (0.43) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6488989 0.84 ALDH1A1 (0.47) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6489150 0.83 ALDH1A1 (0.39) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6500809 0.82 NPC1 (0.43) RAB9ANPC1LMNASMN1; SMN2GAA
SCHEMBL6486722 0.82 FAAH (0.45) RAB9ANPC1MEN1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US claimed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US claimed
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
EP-1442041-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-08-04 EP disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US disclosed
WO-2003040147-A1 AZABICYCLIC-SUBSTITUTED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE__________________________________________________________________________________________________________________________ PHARMACIA & UPJOHN COMPANY (US) 2003-05-15 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-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease MALT1, WFS1, NR5A1 RAB9A 1437/4885NPC1 224/4885LMNA 2990/4885

“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.