SCHEMBL7238602

SCHEMBL7238602

CCCOC(=O)CC(C)(CCCN1CCC(NC(=O)c2cc(Cl)ccc2-c2ccc(Cl)cc2)CC1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 4/20 0.43
▸ HTR1A P08908 2/20 0.43
▸ SLC6A12 P48065 1/20 0.42
▸ UBE2M P61081 1/20 0.41
▸ DCUN1D1 Q96GG9 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CCR1 P32246 2/20 0.39
▸ CCR3 P51677 2/20 0.39
▸ HTR4 Q13639 4/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KCNA3 P22001 1/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 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
SCHEMBL7232099 0.95 MTTP (0.43) HTR7HTR1APOLBCCR1CCR3
SCHEMBL7238486 0.94 HTR7 (0.43) HTR7HTR1ASLC6A12UBE2MDCUN1D1
SCHEMBL7234407 0.92 SLC6A12 (0.44) HTR7HTR1ASLC6A12POLBCCR1
SCHEMBL7235323 0.91 KCNA3 (0.45) HTR7HTR1ASLC6A12UBE2MDCUN1D1
SCHEMBL7238553 0.90 HTR7 (0.43) HTR7HTR1ASLC6A12UBE2MDCUN1D1
SCHEMBL7232909 0.90 HTR7 (0.48) HTR7HTR1APOLBCCR3HTR4
SCHEMBL7241958 0.89 HTR7 (0.47) HTR7HTR1APOLBCCR3KMT2A
SCHEMBL7243256 0.89 HTR1A (0.42) HTR7HTR1ASLC6A12UBE2MDCUN1D1
SCHEMBL7235760 0.89 HTR7 (0.45) HTR7HTR1APOLBCCR1CCR3
SCHEMBL7235373 0.87 MTTP (0.44) HTR7HTR1APOLBCCR3KCNA3

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
US-6617325-B1 Inhibitors of the microsomal triglyceride-transfer protein BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-09-09 — — US disclosed
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