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SCHEMBL7463521

SCHEMBL7463521

O=C(CNC(=O)c1ccc[nH]1)NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.66
▸ CCR1 P32246 4/20 0.41
▸ KCNA3 P22001 1/20 0.41
▸ PLD2 O14939 1/20 0.41
▸ PLD1 Q13393 1/20 0.41
▸ CCR3 P51677 4/20 0.40
▸ HTR7 P34969 4/20 0.40
▸ ADRA1D P25100 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ ADRA1B P35368 1/20 0.39

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
SCHEMBL7469453 0.94 MCHR1 (0.59) MCHR1CCR1KCNA3PLD2PLD1
SCHEMBL7464781 0.87 MCHR1 (0.73) MCHR1CCR1KCNA3CCR3HTR7
SCHEMBL7462229 0.85 MCHR1 (0.62) MCHR1PLD2
SCHEMBL7470119 0.84 MCHR1 (0.68) MCHR1CCR1KCNA3CCR3HTR7
SCHEMBL7464749 0.83 MCHR1 (0.61) MCHR1CCR1HTR7ADRA1A
SCHEMBL7467493 0.83 MCHR1 (0.61) MCHR1CCR1HTR7ADRA1A
SCHEMBL7466997 0.83 MCHR1 (0.61) MCHR1CCR1KCNA3CCR3HTR7
SCHEMBL7462164 0.83 MCHR1 (0.62) MCHR1
SCHEMBL7463548 0.83 MCHR1 (0.60) MCHR1CCR1ADRA1A
SCHEMBL7460278 0.83 MCHR1 (0.71) MCHR1CCR1KCNA3CCR3HTR7

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
EP-1219294-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2002-07-03 — — EP disclosed