SCHEMBL7401502

SCHEMBL7401502

[CH2]Cc1cc(OC)c(OC)cc1Br

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.48
TAAR1 Q96RJ0 3/20 0.48
HTR2C P28335 1/20 0.48
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 1/20 0.45
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PRKDC P78527 1/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42

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
SCHEMBL25238972 0.85 HTR2A (0.61) HTR2ATAAR1HTR2C
SCHEMBL29758521 0.80 HTR2A (0.52) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL13753907 0.80 SMN1; SMN2 (0.57) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL2294326 0.80 HTR2A (0.52) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL900127 0.79 HTR2A (0.52) HTR2ATAAR1SMN1; SMN2L3MBTL1
SCHEMBL15780158 0.78 HTR2A (0.48) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL31316994 0.78 PDE4A (0.57) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL130898 0.78 PDE4A (0.57) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL10049625 0.78 HTR2A (0.48) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL131156 0.78 HTR2A (0.48) HTR2ATAAR1HTR2CCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8540904-B2 Composition for ultraviolet absorbent substance and ultraviolet absorbent substance comprising same SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2013-09-24 US disclosed
US-20120313058-A1 COMPOSITION FOR ULTRAVIOLET ABSORBENT SUBSTANCE AND ULTRAVIOLET ABSORBENT SUBSTANCE COMPRISING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2012-12-13 US disclosed
CN-1134412-C N-substituted 2-cyanopyrodlidines ��Ұ����ҩ��ʽ���� 2004-01-14 CN disclosed
CN-1236361-A N-substituted 2-cyanopyrrolidines NOVARTIS AG (CH) 1999-11-24 CN disclosed
EP-0937040-A2 N-SUBSTITUTED 2-CYANOPYRROLIDINES Novartis AG (CH) 1999-08-25 EP disclosed
WO-1998019998-A2 N-SUBSTITUTED 2-CYANOPYRROLIDINES NOVARTIS AG (CH) 1998-05-14 WO disclosed