SCHEMBL22634135

SCHEMBL22634135

CC(=O)NNC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.63
▸ DRD4 P21917 3/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ DRD2 P14416 1/20 0.59
▸ DRD3 P35462 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ DPP7 Q9UHL4 1/20 0.58
▸ ACHE P22303 2/20 0.57
▸ BACE1 P56817 2/20 0.57
▸ BCHE P06276 1/20 0.57
▸ MEN1 O00255 1/20 0.56

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
SCHEMBL4133414 0.88 SIGMAR1 (0.67) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL3164487 0.87 SIGMAR1 (0.74) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL8553564 0.84 DRD4 (0.70) SIGMAR1DRD4KMT2ADRD2ACHE
Hydrochloric Acid SCHEMBL27514643 0.82 DRD4 (0.56) SIGMAR1DRD4
SCHEMBL17610278 0.82 BCHE (0.62) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL3635817 0.81 KMT2A (0.56) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL7393471 0.81 DRD4 (0.67) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL1781392 0.81 DRD4 (0.67) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL7500995 0.81 DRD4 (0.67) SIGMAR1DRD4KMT2ADRD2DRD3
SCHEMBL8185713 0.81 CYP2C19 (0.62) SIGMAR1KMT2ADPP7

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-20200352917-A1 MEDICATED SPRAY FOR TREATMENT OF SUBSTANCE ABUSE, OVERDOSE, ADDICTION AND IMPULSE CONTROL DISORDERS GOOBERMAN LANCE L (US) 2020-11-12 — — US disclosed
Send feedback