SCHEMBL7235483

SCHEMBL7235483

CCC(CCCN1CCC(NC(=O)c2cc(Cl)ccc2-c2ccc(Cl)cc2)CC1)(CC(=O)OC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 2/20 0.43
▸ SLC6A12 P48065 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ CCR1 P32246 2/20 0.42
▸ CCR3 P51677 2/20 0.42
▸ HTR4 Q13639 6/20 0.41
▸ UBE2M P61081 1/20 0.41
▸ DCUN1D1 Q96GG9 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ POLB P06746 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
SCHEMBL7242329 0.94 MTTP (0.44) HTR7HTR1ACCR1CCR3HTR4
SCHEMBL7238532 0.94 HTR7 (0.42) HTR7SLC6A12HTR1ACCR1CCR3
SCHEMBL7237774 0.93 KCNA3 (0.42) HTR7SLC6A12HTR1ACCR1CCR3
SCHEMBL7238553 0.93 HTR7 (0.43) HTR7SLC6A12HTR1ACCR1CCR3
SCHEMBL7242396 0.93 HTR7 (0.41) HTR7SLC6A12HTR1ACCR1CCR3
SCHEMBL7570480 0.90 SLC6A12 (0.48) HTR7SLC6A12HTR1ACCR3HTR4
SCHEMBL7236097 0.89 HTR7 (0.47) HTR7SLC6A12HTR1ACCR3HTR4
SCHEMBL7234407 0.89 SLC6A12 (0.44) HTR7SLC6A12HTR1ACCR1CCR3
SCHEMBL7241451 0.89 HTR7 (0.49) HTR7HTR1ACCR3KMT2APOLB
SCHEMBL7243455 0.88 HTR7 (0.45) HTR7HTR1ACCR1CCR3HTR4

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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