SCHEMBL5829618

SCHEMBL5829618

c1ccc([AsH]c2ncnc3[nH]cnc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
DPP4 P27487 1/20 0.32
LMNA P02545 2/20 0.31
MAPK1 P28482 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CDK2 P24941 1/20 0.31
TTBK1 Q5TCY1 1/20 0.31
TTBK2 Q6IQ55 1/20 0.31
TRPA1 O75762 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL1081382 0.76 LMNA (0.38) JAK2HSD17B10HPGDDPP4LMNA
SCHEMBL5829620 0.73 CDC7 (0.48) HSD17B10ALDH1A1HPGDLMNAMAPK1
SCHEMBL2938674 0.70 JAK2 (0.54) JAK2KDM4EHSD17B10ALDH1A1GAA
Biphenyl SCHEMBL19716178 0.69 MAP4K4 (0.44) JAK2KDM4EDPP4LMNACYP3A4
SCHEMBL891009 0.68 TTBK1 (0.57) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL2623130 0.67 TRPA1 (0.58) ALDH1A1HPGDCYP1A2TSHRTTBK1
SCHEMBL5384430 0.67 LMNA (0.40) HSD17B10LMNAMAPK1CYP1A2CYP2D6
SCHEMBL796397 0.67 LMNA (0.44) JAK2KDM4EHSD17B10ALDH1A1GLA
SCHEMBL5808902 0.66 SMN1; SMN2 (0.42) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL6663881 0.66 MEN1 (0.47) KDM4EALDH1A1GLAHPGDMAPK1

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-1673439-A2 METHODS FOR ALTERING MRNA SPLICING AND TREATING FAMILIAL DYSAUTONOMIA AND OTHER MECHANISTICALLY RELATED DISORDERS THE GENERAL HOSPITAL CORPORATION (US) 2006-06-28 EP disclosed
WO-2005033290-A2 METHODS FOR ALTERING MRNA SPLICING AND TREATING FAMILIAL DYSAUTONOMIA AND OTHER MECHANISTICALLY RELATED DISORDERS THE GENERAL HOSPITAL CORPORATION (US) 2005-04-14 WO disclosed