SCHEMBL16229754

SCHEMBL16229754

CN1C2C1C21Cc2cc(F)c(CCNS(=O)(=O)C3CCC3)cc2C1Cc1cccc(F)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.32
ATM Q13315 1/20 0.31
DGAT1 O75907 1/20 0.30
MGAT3 Q09327 1/20 0.30
MGAT2 Q10469 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
NR1D1 P20393 1/20 0.30
HTR2A P28223 3/20 0.30
HTR2C P28335 2/20 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
SCHEMBL16229778 0.93 NR1D1 (0.33) NR1D1
SCHEMBL16229769 0.92 DPP4 (0.34) RORC
SCHEMBL16229759 0.92 RORC (0.33) RORCPOLB
SCHEMBL16229795 0.91 GALR3 (0.35) NR1D1
SCHEMBL16229775 0.89 DGAT1 (0.36) DGAT1MGAT3MGAT2
SCHEMBL16784651 0.87 POLB (0.37) POLBHTR2AHTR2C
SCHEMBL16229799 0.87 SLC6A9 (0.33) DGAT1MGAT3MGAT2HTR2AHTR2C
SCHEMBL16784638 0.84 LMNA (0.34) NR1D1
SCHEMBL16229784 0.84 DPP4 (0.34) RORCGAA
SCHEMBL16784634 0.83 POLB (0.35) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051280-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2015-06-09 US disclosed
US-8883839-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy ABBOTT LABORATORIES (US) 2014-11-11 US disclosed