SCHEMBL6494474

SCHEMBL6494474

Cc1ccc(C(=O)NC2CC3CC2CN3)o1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 2/20 0.43
KLK7 P49862 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
CHRNB2 P17787 3/20 0.42
CHRNA4 P43681 3/20 0.42
CHRNA7 P36544 2/20 0.42
CHRNB4 P30926 2/20 0.42
CHRNA3 P32297 2/20 0.42
KMT2A Q03164 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
SCHEMBL6488105 0.84 CHRNB2 (0.46) HPGDALDH1A1TSHRL3MBTL1CHRNB2
SCHEMBL6490145 0.84 KMT2A (0.54) HPGDSMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL6489595 0.83 MMP13 (0.43) HPGDSMN1; SMN2ALDH1A1HSD17B10POLB
SCHEMBL6488977 0.82 ALDH1A1 (0.53) HPGDSMN1; SMN2ALDH1A1POLBKMT2A
SCHEMBL6489856 0.81 ERCC5 (0.45) HPGDSMN1; SMN2ALDH1A1POLBL3MBTL1
SCHEMBL6496112 0.81 SLC9A1 (0.46) HPGDSMN1; SMN2ALDH1A1POLBL3MBTL1
SCHEMBL6485912 0.79 ALDH1A1 (0.43) HPGDSMN1; SMN2ALDH1A1HSD17B10POLB
SCHEMBL6499881 0.79 MAPKAPK2 (0.45) HPGDALDH1A1HSD17B10POLBL3MBTL1
SCHEMBL6486556 0.78 ALDH1A1 (0.42) HPGDSMN1; SMN2ALDH1A1HSD17B10POLB
SCHEMBL6489862 0.78 NPC1 (0.56) HPGDSMN1; SMN2ALDH1A1HSD17B10TSHR

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 HPGD 706/4885SMN1; SMN2 1751/4885ALDH1A1 625/4885

“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.