SCHEMBL7569221

SCHEMBL7569221

Cc1ccc(-c2ccccc2)c(C(=O)NC2CCN(CCCC(C)(CC(=O)O)c3ccccc3)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.42
▸ HTR7 P34969 3/20 0.42
▸ CCR3 P51677 1/20 0.42
▸ ADRA1A P35348 2/20 0.41
▸ ADRA1D P25100 1/20 0.41
▸ ADRA1B P35368 1/20 0.41
▸ DRD4 P21917 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ MAOB P27338 1/20 0.41
▸ CARM1 Q86X55 1/20 0.40
▸ PRMT6 Q96LA8 1/20 0.40
▸ MTTP P55157 2/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ TBXA2R P21731 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ SLC6A2 P23975 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
SCHEMBL7570284 0.91 SLC6A12 (0.47) KCNA3HTR7CCR3ADRA1AADRA1D
Bicarbonate SCHEMBL7565338 0.91 HTR7 (0.43) KCNA3HTR7CCR3ADRA1AADRA1D
SCHEMBL6220682 0.90 MTTP (0.48) KCNA3HTR7CCR3ADRA1AADRA1D
SCHEMBL7565747 0.89 POLB (0.48) KCNA3HTR7CCR3ADRA1ADRD4
Bicarbonate SCHEMBL7569224 0.89 HTR7 (0.43) KCNA3HTR7CCR3ADRA1AADRA1D
SCHEMBL7565332 0.88 HTR7 (0.42) HTR7CCR3ADRA1AADRA1DADRA1B
SCHEMBL6219319 0.84 MTTP (0.47) HTR7CCR3ADRA1ADRD4POLB
SCHEMBL6216605 0.84 MTTP (0.58) HTR7CCR3ADRA1AADRA1DADRA1B
SCHEMBL7243454 0.83 MTTP (0.46) KCNA3HTR7CCR3ADRA1ADRD4
SCHEMBL6217670 0.83 POLB (0.47) KCNA3HTR7CCR3ADRA1ADRD4

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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