SCHEMBL7571721

SCHEMBL7571721

CCC(CCCN1CCC(NC(=O)c2cc(OC)ccc2-c2ccccc2)CC1)(CC(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ HTR7 P34969 1/20 0.42
▸ HTR4 Q13639 6/20 0.42
▸ MCHR1 Q99705 2/20 0.42
▸ MAOB P27338 2/20 0.42
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CCR3 P51677 1/20 0.41

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
SCHEMBL6217316 0.91 POLB (0.45) POLBHTR7HTR4MCHR1SLC6A2
SCHEMBL7565332 0.90 HTR7 (0.42) POLBHTR7HTR4MAOBSLC6A2
SCHEMBL7570480 0.90 SLC6A12 (0.48) HTR7HTR4CCR3
SCHEMBL7565747 0.89 POLB (0.48) POLBHTR7MCHR1MAOBSLC6A2
SCHEMBL7242152 0.88 HTR7 (0.49) HTR7SLC6A2DRD4CCR3
SCHEMBL7570492 0.88 MTTP (0.47) HTR7SLC6A2SLC6A4DRD4CCR3
Bicarbonate SCHEMBL7564901 0.87 POLB (0.48) POLBHTR7MCHR1MAOBDRD4
Bicarbonate SCHEMBL7565748 0.86 POLB (0.50) POLBHTR7HTR4MCHR1MAOB
SCHEMBL7234335 0.86 POLB (0.45) POLBHTR7HTR4MCHR1SLC6A2
SCHEMBL7241451 0.84 HTR7 (0.49) POLBHTR7SLC6A2DRD4CCR3

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
EP-1202969-A2 BIPHENYL DERIVATIVES, PRODUCTION THEREOF AND USE AS MEDICINES Boehringer Ingelheim Pharma KG (DE) 2002-05-08 — — EP disclosed
WO-2001005762-A2 BIPHENYL DERIVATIVES, PRODUCTION THEREOF AND USE AS MTP INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-01-25 — — WO disclosed
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