SCHEMBL8023923

SCHEMBL8023923

O=C(Cc1ccccc1F)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 20/20 1.00

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
SCHEMBL8035527 0.93 SIGMAR1 (1.00) SIGMAR1
SCHEMBL8033644 0.91 SIGMAR1 (1.00) SIGMAR1
SCHEMBL8035627 0.90 SIGMAR1 (1.00) SIGMAR1
SCHEMBL16480408 0.90 SIGMAR1 (0.81) SIGMAR1
SCHEMBL3657801 0.86 SIGMAR1 (0.74) SIGMAR1
SCHEMBL5862113 0.85 SIGMAR1 (1.00) SIGMAR1
SCHEMBL2317574 0.85 SIGMAR1 (0.76) SIGMAR1
SCHEMBL5862050 0.84 SIGMAR1 (1.00) SIGMAR1
SCHEMBL8037825 0.84 SIGMAR1 (1.00) SIGMAR1
SCHEMBL1473936 0.82 SIGMAR1 (0.70) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000071171-A2 SIGMA-1 LIGANDS FOR DETERMINING CARCINOMA PROLIFERATIVE STATUS WAKE FOREST UNIVERSITY (US) 2000-11-30 WO claimed
WO-2000071171-A2 SIGMA-1 LIGANDS FOR DETERMINING CARCINOMA PROLIFERATIVE STATUS WAKE FOREST UNIVERSITY (US) 2000-11-30 WO disclosed