SCHEMBL8129651

SCHEMBL8129651

O=C(O)Oc1ccccc1Nc1ccccc1OC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.45
AKR1C2 P52895 2/20 0.45
KDM4E B2RXH2 2/20 0.42
APAF1 O14727 1/20 0.42
RECQL P46063 1/20 0.42
CASP6 P55212 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
MCL1 Q07820 1/20 0.42
CASP8 Q14790 1/20 0.42
FABP4 P15090 3/20 0.41
FABP3 P05413 2/20 0.41
FABP5 Q01469 2/20 0.41
HSD17B10 Q99714 2/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 3/20 0.40
HPGD P15428 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL10721263 0.91 AKR1C3 (0.57) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL10721533 0.91 CXCR2 (0.45) AKR1C3AKR1C2KDM4EHSD17B10GAA
SCHEMBL1360923 0.90 MAPT (0.51) AKR1C3AKR1C2KDM4ERECQLFABP4
SCHEMBL5181747 0.83 MAPK1 (0.57) AKR1C3AKR1C2KDM4EGAAKMT2A
SCHEMBL10886623 0.82 MAPT (0.61) KDM4ERECQLCASP6FABP4HSD17B10
SCHEMBL10719145 0.82 NPC1 (0.56) AKR1C3AKR1C2KDM4EHSD17B10GAA
SCHEMBL143632 0.81 KDM4E (0.46) KDM4EHSD17B10KMT2AHPGDALDH1A1
SCHEMBL14403113 0.79 HSD17B10 (0.46) KDM4EFABP4HSD17B10GAAKMT2A
SCHEMBL6488638 0.77 KMT2A (0.55) KDM4EGAAKMT2AHPGDALDH1A1
SCHEMBL10719287 0.77 RAB9A (0.50) KDM4EKMT2AHPGDALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697744-B1 Organic electroluminescent device PHILIPS PATENTVERWALTUNG (DE) 2000-01-05 EP disclosed
EP-0697744-A1 Organic electroluminescent device Philips Patentverwaltung GmbH (DE) 1996-02-21 EP disclosed