SCHEMBL8035229

SCHEMBL8035229

CC(=O)C1CNCCC1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.48
MC4R P32245 1/20 0.44
MAPT P10636 1/20 0.41
PKM P14618 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
SCHEMBL28494730 0.82 PKM (0.60) GBA1MAPTPKM
SCHEMBL11680968 0.81 GBA1 (0.53) GBA1
Hydrochloric Acid SCHEMBL11685174 0.79 GBA1 (0.51) GBA1MAPTPKM
SCHEMBL7806051 0.78 ALDH1A1 (0.41)
SCHEMBL7006297 0.76 GBA1 (0.53) GBA1
SCHEMBL5205480 0.76 GBA1 (0.68) GBA1
SCHEMBL6001919 0.76 GBA1 (0.68) GBA1
SCHEMBL5973809 0.76 GBA1 (0.68) GBA1
SCHEMBL5974321 0.76 GBA1 (0.68) GBA1
SCHEMBL7242431 0.76 GBA1 (0.53) GBA1

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-6043257-A ANTICOAGULANT; PYRIDINE SUBSTITUTED INDAZOLE COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-03-28 US disclosed