SCHEMBL10487267

SCHEMBL10487267

CC1Cc2cc3c(cc2CC(N)C1)OCC3

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.44
DRD3 P35462 6/20 0.44
PRKCI P41743 1/20 0.34
DYRK1A Q13627 2/20 0.34
PIK3CA P42336 1/20 0.34
DYRK2 Q92630 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
FYN P06241 1/20 0.32

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
SCHEMBL8845099 0.79 DRD2 (0.54) DRD2DRD3PRKCIMTNR1AMTNR1B
SCHEMBL10574411 0.79 DRD2 (0.54) DRD2DRD3PRKCIMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL10577359 0.78 DRD2 (0.52) DRD2DRD3MTNR1AMTNR1B
SCHEMBL10487260 0.78 DRD2 (0.46) DRD2DRD3PRKCIDYRK1APIK3CA
Hydrochloric Acid SCHEMBL10487255 0.78 DRD2 (0.52) DRD2DRD3MTNR1AMTNR1B
SCHEMBL10487375 0.76 DRD2 (0.48) DRD2DRD3PRKCIMTNR1AMTNR1B
SCHEMBL10487367 0.74 DRD2 (0.52) DRD2DRD3PRKCIDYRK1APIK3CA
SCHEMBL984492 0.71 PRKCI (0.48) DRD2DRD3PRKCIDYRK1ADYRK2
SCHEMBL23519758 0.70 DRD2 (0.55) DRD2DRD3PRKCIDYRK1APIK3CA
SCHEMBL25086433 0.70 DRD2 (0.48) DRD2DRD3PRKCIDYRK1APIK3CA

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
US-4874878-A CHEMICAL INTERMEDIATES FOR ANTIDEPRESSANTS ADIR ET CIE (FR) 1989-10-17 US disclosed
US-4851429-A ANTIDEPRESSANT, TRANQUILIZERS ADIR ET CIE (FR) 1989-07-25 US disclosed