SCHEMBL7570284

SCHEMBL7570284

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC6A12 P48065 1/20 0.47
▸ HTR7 P34969 3/20 0.47
▸ HTR1A P08908 2/20 0.47
▸ KCNA3 P22001 1/20 0.42
▸ CCR3 P51677 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ ADRA1D P25100 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ ADRA1B P35368 1/20 0.41
▸ CCR1 P32246 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ HTR4 Q13639 2/20 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
SCHEMBL6219319 0.91 MTTP (0.47) SLC6A12HTR7HTR1ACCR3MEN1
Bicarbonate SCHEMBL7570482 0.91 SLC6A12 (0.47) SLC6A12HTR7HTR1AKCNA3CCR3
SCHEMBL7569221 0.91 KCNA3 (0.42) HTR7HTR1AKCNA3CCR3MEN1
SCHEMBL7234407 0.90 SLC6A12 (0.44) SLC6A12HTR7HTR1AKCNA3CCR3
SCHEMBL7235323 0.89 KCNA3 (0.45) SLC6A12HTR7HTR1AKCNA3CCR3
SCHEMBL7565747 0.89 POLB (0.48) HTR7HTR1AKCNA3CCR3HTR2A
Bicarbonate SCHEMBL7570288 0.89 SLC6A12 (0.49) SLC6A12HTR7HTR1ACCR3MEN1
SCHEMBL7570480 0.88 SLC6A12 (0.48) SLC6A12HTR7HTR1ACCR3HTR4
SCHEMBL7238486 0.88 HTR7 (0.43) SLC6A12HTR7HTR1AKCNA3CCR3
SCHEMBL7243256 0.87 HTR1A (0.42) SLC6A12HTR7HTR1AKCNA3CCR3

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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