SCHEMBL7650153

SCHEMBL7650153

CC/C(=C(\c1ccccc1)c1ccc(OCCN2CCCCC2)cc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 7/20 1.00
PSMB5 P28074 6/20 1.00
ESR1 P03372 6/20 1.00
PSMB2 P49721 3/20 1.00
PDE1A P54750 9/20 0.89
PDE1B Q01064 9/20 0.89
PDE1C Q14123 9/20 0.89
ESR2 Q92731 1/20 0.89

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
SCHEMBL30902018 1.00 PSMB1 (1.00) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL7650156 1.00 PSMB1 (1.00) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL29822053 1.00 PSMB1 (1.00) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL15648408 1.00 PSMB1 (1.00) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL24505428 0.95 ESR1 (0.91) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL7807876 0.95 ESR1 (0.91) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL17151967 0.95 ESR1 (0.91) PSMB1PSMB5ESR1PSMB2PDE1A
SCHEMBL23266947 0.95 ESR1 (0.90) PSMB1PSMB5ESR1PSMB2PDE1A
Idoxifene SCHEMBL19217 0.94 PDE1A (1.00) PSMB1PSMB5ESR1PSMB2PDE1A
Idoxifene SCHEMBL3774574 0.94 PDE1A (1.00) PSMB1PSMB5ESR1PSMB2PDE1A

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-6489481-B1 COMPOUNDS USED FOR TREATMENT AND/OR PREVENTION OF NEURONAL APOPTOSIS AND/OR EXCITOTOXICITY RELATED NEUROLOGICAL DISORDERS ASTRAZENECA AB (SE) 2002-12-03 US disclosed
EP-1127045-A2 USE OF TRIPHENYLBUTENE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS AstraZeneca AB (SE) 2001-08-29 EP disclosed
WO-2000025767-A2 USE OF TRIPHENYLBUTENE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS ASTRAZENECA AB (SE) 2000-05-11 WO disclosed