SCHEMBL23978134

SCHEMBL23978134

COCc1ccccc1C(C)=N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
PRMT5 O14744 1/20 0.37
IDO1 P14902 4/20 0.37
PDK2 Q15119 1/20 0.36
TSHR P16473 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
C5AR1 P21730 1/20 0.36
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
KMT2A Q03164 2/20 0.33
HPGD P15428 1/20 0.33
F2 P00734 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
TMPRSS6 Q8IU80 1/20 0.33
ST14 Q9Y5Y6 1/20 0.33

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
SCHEMBL3145722 0.80 LMNA (0.46) ALDH1A1LMNAPRMT5TSHRHDAC3
SCHEMBL2513310 0.80 ALDH1A1 (0.39) ALDH1A1LMNAPRMT5IDO1PDK2
SCHEMBL17064010 0.79 PRMT5 (0.38) ALDH1A1LMNAPRMT5PDK2TSHR
SCHEMBL16245167 0.78 TSHR (0.46) ALDH1A1LMNAPRMT5TSHRHDAC3
SCHEMBL21319068 0.77 GABRA1 (0.44) ALDH1A1LMNATSHRMAPTTP53
SCHEMBL29083919 0.76 PRMT5 (0.37) ALDH1A1LMNAPRMT5PDK2TSHR
SCHEMBL534811 0.76 HTT (0.56) ALDH1A1TSHRHPGDTDP1TP53
SCHEMBL31617745 0.76 HTT (0.56) ALDH1A1TSHRHPGDTDP1TP53
SCHEMBL648491 0.75 IDO1 (0.44) ALDH1A1IDO1PDK2TSHRKMT2A
SCHEMBL6600262 0.74 ALDH1A1 (0.44) ALDH1A1LMNAPRMT5TSHRHDAC3

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-3903581-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS I BASF SE (DE) 2021-11-03 EP disclosed