SCHEMBL19767751

SCHEMBL19767751

O=C(O)c1ccc(Br)cc1-c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.51
AKR1C2 P52895 1/20 0.51
AKR1C1 Q04828 1/20 0.51
KDM4E B2RXH2 1/20 0.50
GLA P06280 1/20 0.50
RXFP1 Q9HBX9 2/20 0.49
HSD17B10 Q99714 1/20 0.48
PTPN1 P18031 1/20 0.47
ALAD P13716 1/20 0.44
EPRS1 P07814 2/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.42
MCL1 Q07820 1/20 0.42
MYC P01106 1/20 0.42
NR4A1 P22736 1/20 0.42
CFD P00746 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL14873563 0.98 AKR1C3 (0.53) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL629723 0.90 AKR1C3 (0.64) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL12149148 0.86 HSD17B10 (0.50) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL18223995 0.85 KDM1A (0.54) AKR1C3AKR1C2AKR1C1KDM4EHSD17B10
SCHEMBL31279164 0.85 AKR1C3 (0.43) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL31327315 0.84 HSD17B10 (0.58) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL10026168 0.84 HSD17B10 (0.58) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL31278450 0.84 S1PR1 (0.44) AKR1C3AKR1C2AKR1C1KDM4EGLA
Hydrochloric Acid SCHEMBL20943641 0.82 HSD17B10 (0.56) AKR1C3AKR1C2AKR1C1KDM4EGLA
SCHEMBL4354113 0.82 KDM4E (0.44) AKR1C3AKR1C2AKR1C1KDM4EGLA

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
US-10032984-B2 Polymer and organic light emitting device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-07-24 US disclosed
US-10032984-B2 Polymer and organic light emitting device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-07-24 US disclosed
US-20180019400-A1 POLYMER AND ORGANIC LIGHT EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-01-18 US disclosed
US-20180019400-A1 POLYMER AND ORGANIC LIGHT EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-01-18 US disclosed