SCHEMBL475048

SCHEMBL475048

Nc1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2N)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
HSD17B10 Q99714 1/20 0.60
ADORA2A P29274 5/20 0.59
ADORA1 P30542 4/20 0.59
ADORA3 P0DMS8 4/20 0.59
ADORA2B P29275 3/20 0.59
ALOX15 P16050 1/20 0.59
TSHR P16473 1/20 0.59
POLB P06746 1/20 0.56
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
HPGD P15428 3/20 0.52
MAPT P10636 2/20 0.52
BCHE P06276 1/20 0.51
ACHE P22303 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
HTT P42858 1/20 0.50
GPR68 Q15743 1/20 0.47
ACE2 Q9BYF1 1/20 0.46
KDM4E B2RXH2 2/20 0.46

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
SCHEMBL17273804 1.00 ALDH1A1 (0.60) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL24303191 0.96 ADORA2A (0.56) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL13938618 0.89 ADORA2A (0.78) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL24303403 0.89 ADORA2A (0.50) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL29793563 0.89 ALDH1A1 (0.63) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL10995283 0.89 ALDH1A1 (0.63) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL18347063 0.87 ADORA2A (0.51) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL1712901 0.86 ADORA2A (0.54) ALDH1A1HSD17B10ADORA2AADORA1ADORA3
SCHEMBL16246145 0.84 L3MBTL1 (0.61) ALDH1A1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL19497485 0.81 L3MBTL1 (0.58) ALDH1A1ADORA2AADORA1ADORA3ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8933182-B2 Polymer, its preparation and uses CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-01-13 US disclosed
EP-2166582-B1 Conjugated copolymer comprising triazine, its preparation and uses CAMBRIDGE DISPLAY TECH LTD (GB) 2012-02-01 EP disclosed
US-20110279028-A1 Polymer, Its Preparation and Uses O'DELL RICHARD (DE) 2011-11-17 US disclosed
US-7985815-B2 Polymer, its preparation and uses CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2011-07-26 US disclosed
EP-2166582-A1 Conjugated copolymer comprising triazine, its preparation and uses Cambridge Display Technology Limited (GB) 2010-03-24 EP disclosed
EP-1377627-B1 CONJUGATED HOMO- AND COPOLYMERS COMPRISING SUBSTITUTED OR UNSUBSTITUTED HETEROARYL GROUP, ITS PREPARATION AND USES CAMBRIDGE DISPLAY TECH LTD (GB) 2009-12-16 EP disclosed
US-20040146743-A1 by modulating the semiconductor bandgap of the copolymer it is possible to increase the quantum efficiency of the copolymer when exited to luminesce CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2004-07-29 US disclosed