SCHEMBL8655496

SCHEMBL8655496

CCCCc1c2c(cc(C(=O)c3ccccc3-c3ccccc3)c1N1CCCCC1N)-c1ccccc1C2C(=O)NCC(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ KDM2B Q8NHM5 1/20 0.32
▸ HCRTR1 O43613 4/20 0.31
▸ HCRTR2 O43614 4/20 0.31
▸ CHRNB2 P17787 1/20 0.31
▸ CHRNA4 P43681 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ MTTP P55157 3/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL8668056 0.98 KDM2B (0.34) POLBKDM2BCHRNB2CHRNA4CNR1
SCHEMBL8651738 0.95 POLB (0.31) POLB
SCHEMBL8652846 0.94 NPY2R (0.33) POLBHCRTR1HCRTR2MTTP
SCHEMBL8650741 0.91 POLB (0.31) POLB
SCHEMBL8655156 0.91 HCRTR2 (0.34) POLBHCRTR1HCRTR2
SCHEMBL8343961 0.91 HCRTR2 (0.34) POLBHCRTR2
SCHEMBL8655163 0.91 POLB (0.32) POLB
SCHEMBL8652604 0.90 USP30 (0.32) POLB
SCHEMBL8652533 0.90 PLK1 (0.32) POLB
SCHEMBL8650768 0.90 POLB (0.30) POLB

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-5712279-A Inhibitors of microsomal triglyceride transfer protein and method BRISTOL-MYERS SQUIBB COMPANY (US) 1998-01-27 — — US disclosed
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