SCHEMBL7024434

SCHEMBL7024434

CN1CCN(c2cccc3c2C[C@H](NC(=O)c2ccc(-n4cccc4)cc2)CC3)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ MTNR1A P48039 4/20 0.50
▸ MTNR1B P49286 4/20 0.50
▸ KCNH2 Q12809 5/20 0.48
▸ SCN9A Q15858 5/20 0.48
▸ SCN5A Q14524 4/20 0.48
▸ MEN1 O00255 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ DRD2 P14416 4/20 0.43
▸ HTR2A P28223 3/20 0.43
▸ DRD3 P35462 3/20 0.43
▸ DRD4 P21917 2/20 0.42
▸ AR P10275 2/20 0.41
▸ CTSS P25774 1/20 0.41
▸ HDAC3 O15379 1/20 0.40

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
SCHEMBL7030061 1.00 MAPT (0.54) MAPTRAB9AMTNR1AMTNR1BKCNH2
SCHEMBL7021228 0.88 MTNR1A (0.50) MTNR1AMTNR1BKCNH2SCN9ASCN5A
SCHEMBL7021230 0.88 MTNR1A (0.50) MTNR1AMTNR1BKCNH2SCN9ASCN5A
SCHEMBL7030412 0.88 MTNR1A (0.54) MAPTMTNR1AMTNR1BKCNH2SCN9A
SCHEMBL7030407 0.88 MTNR1A (0.54) MAPTMTNR1AMTNR1BKCNH2SCN9A
SCHEMBL7027929 0.87 MTNR1A (0.65) RAB9AMTNR1AMTNR1BKCNH2SCN9A
SCHEMBL7027930 0.87 MTNR1A (0.65) RAB9AMTNR1AMTNR1BKCNH2SCN9A
SCHEMBL7024053 0.87 DRD2 (0.50) MTNR1AMTNR1BKCNH2SCN9ASCN5A
SCHEMBL7025324 0.87 MTNR1A (0.49) RAB9AMTNR1AMTNR1BKCNH2SCN9A
SCHEMBL7025317 0.87 MTNR1A (0.49) RAB9AMTNR1AMTNR1BKCNH2SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888319-B1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES ASTRAZENECA AB (SE) 2003-01-29 — — EP claimed
US-6124283-A Substituted 1,2,3,4-tetrahydronaphthalene derivatives ASTRA AKTIEBOLAG (SE) 2000-09-26 — — US claimed
EP-0888319-B1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES ASTRAZENECA AB (SE) 2003-01-29 — — EP disclosed
US-6410530-B1 CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS ASTRAZENECA AB (SE) 2002-06-25 — — US disclosed
US-6124283-A Substituted 1,2,3,4-tetrahydronaphthalene derivatives ASTRA AKTIEBOLAG (SE) 2000-09-26 — — US disclosed
EP-0888319-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES Astra Aktiebolag (SE) 1999-01-07 — — EP disclosed
WO-1997034883-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1997-09-25 — — WO disclosed
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