SCHEMBL19002129

SCHEMBL19002129

Cc1nc2nc3[nH]cnc3nc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.34
XDH P47989 1/20 0.33
GDA Q9Y2T3 1/20 0.32
CHEK1 O14757 1/20 0.32
AURKA O14965 1/20 0.32
PDPK1 O15530 1/20 0.32
CHEK2 O96017 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
PRKACA P17612 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
MARK3 P27448 1/20 0.32
RPS6KA3 P51812 1/20 0.32

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
SCHEMBL17090705 0.94 KDM4E (0.44) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL11829105 0.80 ALDH1A1 (0.62) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL11831568 0.80 ADORA3 (0.38) ALDH1A1SMN1; SMN2ADORA3ADORA1
SCHEMBL17265813 0.73 ALDH1A1 (0.60) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL12965796 0.73 ADORA3 (0.36) ALDH1A1SMN1; SMN2ADORA3ADORA1
SCHEMBL10143723 0.71 SMN1; SMN2 (0.44) ALDH1A1KDM4EGAAHPGDSMN1; SMN2
SCHEMBL813686 0.70 METAP2 (0.44) ALDH1A1SMN1; SMN2AURKAADORA3ADORA1
SCHEMBL824434 0.69 ALDH1A1 (0.56) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL11153938 0.68 KDM4E (0.60) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL22516593 0.68 SMN1; SMN2 (0.50) SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3188577-B1 METHOD FOR FORMING ORGANIC COATING ON COPPER SURFACE ROHM & HAAS ELECT MAT (US) 2019-01-30 EP disclosed
EP-3181730-B1 METHOD FOR FORMING ORGANIC COATING ON NICKEL SURFACE ROHM & HAAS ELECT MAT (US) 2018-06-20 EP disclosed
EP-3188577-A1 METHOD FOR FORMING ORGANIC COATING ON COPPER SURFACE Rohm and Haas Electronic Materials LLC (US) 2017-07-05 EP disclosed
US-20170183783-A1 METHOD FOR FORMING ORGANIC COATING ON COPPER SURFACE ROHM & HAAS ELECT MAT (US) 2017-06-29 US disclosed
US-20170181292-A1 METHOD FOR FORMING ORGANIC COATING ON NICKEL SURFACE ROHM & HAAS ELECT MAT (US) 2017-06-22 US disclosed
EP-3181730-A1 METHOD FOR FORMING ORGANIC COATING ON NICKEL SURFACE Rohm and Haas Electronic Materials LLC (US) 2017-06-21 EP disclosed