SCHEMBL7590832

SCHEMBL7590832

CNc1nnc(SSc2nnc(NC)s2)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 3/20 0.41
HPGD P15428 2/20 0.41
ALOX15 P16050 2/20 0.41
POLB P06746 1/20 0.41
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
CA5A P35218 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
RAB9A P51151 9/20 0.37
SMN1; SMN2 Q16637 8/20 0.37
NPC1 O15118 7/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 2/20 0.36

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
SCHEMBL9334846 0.83
SCHEMBL10914255 0.79 CA1 (0.39) KDM4EALDH1A1HSD17B10HPGDALOX15
SCHEMBL11584394 0.78
SCHEMBL11641500 0.78 CA1 (0.59) KDM4EALDH1A1HPGDALOX15CA1
SCHEMBL11723544 0.78 RAB9A (0.57) KDM4EALDH1A1HSD17B10HPGDALOX15
SCHEMBL11639843 0.76 MAPT (0.55) KDM4EALDH1A1HSD17B10HPGDPOLB
SCHEMBL2453618 0.76 SMN1; SMN2 (0.42) KDM4EALDH1A1HSD17B10HPGDALOX15
SCHEMBL2455112 0.76 CA1 (0.41) ALDH1A1HSD17B10HPGDPOLBCA1
SCHEMBL10567617 0.72 ALDH1A1 (0.51) ALDH1A1POLBCA1CA2CA4
SCHEMBL10878301 0.72 SMN1; SMN2 (0.54) ALDH1A1HSD17B10ALOX15CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1241296-A2 Process for stabilizing brightness of lignin-containing fibrous material, a composition for stabilizing the brightness thereof and thus stabilized fibrous material Degussa AG (DE) 2002-09-18 EP disclosed