SCHEMBL15435172

SCHEMBL15435172

N[C@@H](Cc1ccc(-c2ccccc2)cc1)CN1CCc2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MOGAT2 Q3SYC2 10/20 0.56
ABCB1 P08183 2/20 0.49
MLNR O43193 1/20 0.45
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
HTR6 P50406 1/20 0.45
GHSR Q92847 1/20 0.45
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RORC P51449 1/20 0.41
KCNA1 Q09470 1/20 0.40
KCNAB1 Q14722 1/20 0.40
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
EIF2AK2 P19525 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
SCHEMBL15435408 0.90 MOGAT2 (0.57) MOGAT2ABCB1MLNRDRD2DRD3
SCHEMBL16715484 0.89 AR (0.55) MOGAT2PRMT5WDR77MEN1POLB
SCHEMBL15435191 0.85 MOGAT2 (0.75) MOGAT2ABCB1MLNRDRD2DRD3
SCHEMBL15435427 0.80 MOGAT2 (0.63) MOGAT2ABCB1HTR6MEN1KMT2A
SCHEMBL16715485 0.78 AR (0.54) MOGAT2POLB
SCHEMBL15435035 0.77 MOGAT2 (0.63) MOGAT2ABCB1MLNRDRD2DRD3
SCHEMBL16715481 0.76 MOGAT2 (0.68) MOGAT2ABCB1
SCHEMBL15435247 0.73 MOGAT2 (0.69) MOGAT2ABCB1MEN1KMT2A
SCHEMBL15435261 0.73 MOGAT2 (0.81) MOGAT2
SCHEMBL15435356 0.73 MOGAT2 (0.78) MOGAT2DRD2DRD3HTR6HTR2C

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687507-B1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND TAISHO PHARMACEUTICAL CO LTD (JP) 2016-03-09 EP disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
US-9035059-B2 Nitrogen-containing condensed heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-05-19 US disclosed
EP-2687507-A1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND Taisho Pharmaceutical Co., Ltd. (JP) 2014-01-22 EP disclosed