Prometryn

Prometryn

SCHEMBL11160002

CCNc1nc(NCC)nc(SC)n1.CSc1nc(NC(C)C)nc(NC(C)C)n1

nearest known ligand 0.75

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
ALDH1A1 P00352 5/20 0.51
HTT P42858 4/20 0.51
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
TSHR P16473 1/20 0.49
CREBBP Q92793 1/20 0.49
LMNA P02545 1/20 0.47
MAPK1 P28482 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
Ametryne SCHEMBL65196 1.00 POLB (0.54) POLBGAAALDH1A1HTTCYP1A2
Prometryn SCHEMBL7945620 1.00 POLB (0.54) POLBGAAALDH1A1HTTCYP1A2
Ametryne SCHEMBL29368218 1.00 POLB (0.54) POLBGAAALDH1A1HTTCYP1A2
Ametryne SCHEMBL8541067 1.00 POLB (0.54) POLBGAAALDH1A1HTTCYP1A2
Ametryne SCHEMBL11801379 0.94 POLB (0.49) POLBGAAALDH1A1HTTCYP1A2
Ametryne SCHEMBL31093673 0.92 GAA (0.58) POLBGAAALDH1A1HTTCYP1A2
Prometryn SCHEMBL29456674 0.92 GAA (0.58) POLBGAAALDH1A1HTTCYP1A2
Ametryne SCHEMBL8812043 0.92 GAA (0.58) POLBGAAALDH1A1HTTCYP1A2
Prometryn SCHEMBL10969844 0.92 GAA (0.58) POLBGAAALDH1A1HTTCYP1A2
Dimethametryne SCHEMBL6364817 0.92 HTT (0.49) POLBGAAALDH1A1HTTCYP1A2

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-0032242-B1 4H-3,1-BENZOXAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN INHIBITING THE GROWTH OF UNWANTED PLANTS BASF Aktiengesellschaft (DE) 1983-12-14 EP disclosed