SCHEMBL11535480

SCHEMBL11535480

CC(O)N(C)Cn1cnc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ APAF1 O14727 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.53
▸ AGER Q15109 4/20 0.52
▸ MAPT P10636 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ LMNA P02545 3/20 0.48
▸ HTT P42858 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ GAA P10253 1/20 0.48
▸ FDPS P14324 2/20 0.48
▸ GGPS1 O95749 1/20 0.48
▸ CYP11B1 P15538 4/20 0.47
▸ CYP11B2 P19099 4/20 0.47
▸ TNF P01375 1/20 0.47
▸ IDO1 P14902 1/20 0.47
▸ EGLN3 Q9H6Z9 1/20 0.47

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
SCHEMBL11538552 0.86 APAF1 (0.55) APAF1TDP1AGERMAPTMAPK1
SCHEMBL11543377 0.78 TDP1 (0.51) APAF1TDP1AGERMAPTMAPK1
SCHEMBL6175278 0.78 APAF1 (0.68) APAF1TDP1AGERMAPTMAPK1
SCHEMBL6176569 0.78 APAF1 (0.68) APAF1TDP1AGERMAPTMAPK1
SCHEMBL3002573 0.77 TDP1 (0.68) TDP1MAPK1TSHRLMNAHTT
SCHEMBL6174975 0.76 TDP1 (0.68) APAF1TDP1AGERMAPTMAPK1
SCHEMBL11368519 0.76 EGLN3 (0.57) APAF1TDP1AGERMAPTMAPK1
SCHEMBL23927823 0.75 APAF1 (0.60) APAF1TDP1AGERMAPTMAPK1
SCHEMBL23927825 0.75 APAF1 (0.60) APAF1TDP1AGERMAPTMAPK1
SCHEMBL11536548 0.74 TDP1 (0.54) APAF1TDP1AGERMAPK1TSHR

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
US-4177155-A N-AMINOMETHYL-TRIAZOLES AND IMIDAZOLES FOR MAKING ANTIFREEZES NONCORROSIVE CIBA-GEIGY CORPORATION (US) 1979-12-04 — — US claimed
US-4177155-A N-AMINOMETHYL-TRIAZOLES AND IMIDAZOLES FOR MAKING ANTIFREEZES NONCORROSIVE CIBA-GEIGY CORPORATION (US) 1979-12-04 — — US disclosed
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