SCHEMBL11162964

SCHEMBL11162964

CCCCCCNc1nc(C)cc(O)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNM2 P50570 7/20 0.64
▸ GPR84 Q9NQS5 1/20 0.51
▸ MAPK1 P28482 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ KCNH3 Q9ULD8 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ TLR8 Q9NR97 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
SCHEMBL13330002 1.00 DNM2 (0.64) DNM2GPR84MAPK1ALDH1A1LMNA
SCHEMBL13329946 0.82 DNM2 (0.81) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL13329945 0.82 DNM2 (0.81) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL9589312 0.81 DNM2 (0.63) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL13330001 0.81 DNM2 (0.64) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL1194281 0.80 DNM2 (0.78) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL13329951 0.79 DNM2 (0.77) DNM2MAPK1ALDH1A1LMNATSHR
SCHEMBL7865350 0.79 KMT2A (0.50) MAPK1ALDH1A1LMNATSHRTP53
SCHEMBL14441528 0.76 KMT2A (0.67) DNM2HTTKMT2AKCNH3MAPT
SCHEMBL14441519 0.76 KMT2A (0.67) DNM2HTTKMT2AKCNH3MAPT

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
US-4402730-A Pyrimidine derivatives and their use as herbicides SANDOZ LTD. (CH) 1983-09-06 — — US disclosed
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