SCHEMBL8037815

SCHEMBL8037815

OCc1ccc2ccn(C3CCN(Cc4ccccc4)CC3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.52
DRD4 P21917 7/20 0.52
DRD3 P35462 7/20 0.52
SLC6A4 P31645 1/20 0.47
SCD O00767 1/20 0.45
KMT2A Q03164 1/20 0.45
PIK3CA P42336 1/20 0.44
MTOR P42345 1/20 0.44
PIK3CG P48736 1/20 0.44
CXCR4 P61073 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
ACHE P22303 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL7798205 0.88 DRD2 (0.52) DRD2DRD4DRD3SLC6A4KMT2A
SCHEMBL7806905 0.84 DRD2 (0.53) DRD2DRD4DRD3SLC6A4SIGMAR1
SCHEMBL8522036 0.84 DRD2 (0.53) DRD2DRD4DRD3SLC6A4ACHE
SCHEMBL8522038 0.84 DRD2 (0.53) DRD2DRD4DRD3SLC6A4ACHE
SCHEMBL5871750 0.84 ALDH1A1 (0.55) DRD2DRD4DRD3SLC6A4SCD
SCHEMBL7808854 0.84 DRD2 (0.48) DRD2DRD4DRD3SLC6A4KMT2A
SCHEMBL3144999 0.83 DRD2 (0.66) DRD2DRD4DRD3SLC6A4ACHE
Hydrochloric Acid SCHEMBL8031499 0.83 DRD2 (0.47) DRD2DRD4DRD3SLC6A4KMT2A
SCHEMBL5871737 0.81 SCD (0.45) DRD2DRD4DRD3SLC6A4SCD
SCHEMBL5871348 0.81 KMT2A (0.53) DRD2DRD4DRD3SLC6A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6046205-A FOR TREATMENT OF VENOUS INSUFFICIENCY AND OF ASSOCIATED DISORDERS, AND ALSO IN THE TREATMENT OF MIGRAINE ADIR ET COMPAGNIE (FR) 2000-04-04 US disclosed
US-6020336-A Indole and indazole compounds LES LABORATOIRES SERVIER (FR) 2000-02-01 US disclosed
EP-0902027-A1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-03-17 EP disclosed