SCHEMBL16229762

SCHEMBL16229762

CN1C2C1C21Cc2cc(F)c(CNS(=O)(=O)CC3CC3)cc2C1Cc1cccc(F)c1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 2/20 0.31
GALR3 O60755 1/20 0.31
SMYD3 Q9H7B4 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
CARM1 Q86X55 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
NR1D2 Q14995 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
SLC6A9 P48067 1/20 0.30
CCNT1 O60563 1/20 0.30
MET P08581 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
SCHEMBL16784629 0.92 LMNA (0.36) KMT2ALMNAGALR3MAPTSLC6A9
SCHEMBL16229799 0.92 SLC6A9 (0.33) KMT2ASMYD3HTR2AHTR2CTRPV1
SCHEMBL16229764 0.92 KMT2A (0.32) KMT2ALMNAGALR3SMYD3SLC6A9
SCHEMBL16784643 0.90 GALR3 (0.43) GALR3TRPV1CARM1PRMT6SLC6A9
SCHEMBL16784642 0.89 SLC6A9 (0.35) KMT2APOLBLMNAGALR3SMYD3
SCHEMBL16229759 0.87 RORC (0.33) KMT2APOLBCARM1PRMT6NR1D2
SCHEMBL16784625 0.85 SLC6A9 (0.39) POLBHTR2ASLC6A9CCNT1
SCHEMBL16229782 0.84 SLC6A9 (0.39) KMT2ALMNASLC6A9
SCHEMBL16229785 0.84 DGAT1 (0.36) KMT2APOLBSMYD3SLC6A9
SCHEMBL16229756 0.84 SLC6A9 (0.32) SLC6A9

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