SCHEMBL14775161

SCHEMBL14775161

FC(F)(F)c1ccc(CC2CNCCN2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
LTA4H P09960 2/20 0.40
HTR2C P28335 5/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HTR2A P28223 3/20 0.37
HTR2B P41595 3/20 0.37
MITF O75030 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
PARP1 P09874 1/20 0.37

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
SCHEMBL13962591 0.86 TAAR1 (0.44) LTA4HHTR2CSLC6A2SLC6A4TAAR1
SCHEMBL4292539 0.84 TAAR1 (0.42) LTA4HHTR2CSLC6A2SLC6A4TAAR1
SCHEMBL5562915 0.84 TAAR1 (0.42) LTA4HHTR2CSLC6A2SLC6A4TAAR1
SCHEMBL5562909 0.84 TAAR1 (0.42) LTA4HHTR2CSLC6A2SLC6A4TAAR1
SCHEMBL26881718 0.81 HRH3 (0.49) HRH3LTA4HSLC6A2SLC6A4PARP1
SCHEMBL5504868 0.81 HRH3 (0.49) HRH3LTA4HSLC6A2SLC6A4PARP1
SCHEMBL10132546 0.79 POLB (0.56) LTA4HHTR2C
SCHEMBL22456442 0.79 POLB (0.56) LTA4HHTR2C
SCHEMBL4749981 0.78 HRH3 (0.49) HRH3LTA4HL3MBTL1PARP1
SCHEMBL5563370 0.78 HRH3 (0.49) HRH3LTA4HHTR2CHTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
CN-1152877-C Piperazine derivatives ����ҩƷ��ҵ��ʽ���� 2004-06-09 CN disclosed
CN-1334812-A Piperazine derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2002-02-06 CN disclosed