SCHEMBL22563822

SCHEMBL22563822

CCCOC(=O)c1cccc(F)c1COc1ccn(S)n1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
L3MBTL1 Q9Y468 4/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 4/20 0.39
JMJD6 Q6NYC1 2/20 0.36
TSHR P16473 5/20 0.36
LMNA P02545 3/20 0.36
PDK2 Q15119 1/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
MAPK1 P28482 2/20 0.35
NPC1 O15118 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL22563850 0.91 JMJD6 (0.44) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22564214 0.88 ALDH1A1 (0.44) ALDH1A1L3MBTL1TDP1JMJD6TSHR
SCHEMBL22564288 0.88 ALDH1A1 (0.44) ALDH1A1L3MBTL1TDP1JMJD6TSHR
SCHEMBL18504421 0.88 ALDH1A1 (0.44) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22564032 0.88 ALDH1A1 (0.41) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22564301 0.87 ALDH1A1 (0.43) ALDH1A1L3MBTL1KMT2ATDP1JMJD6
SCHEMBL22563998 0.87 ALDH1A1 (0.43) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22563954 0.87 KMT2A (0.42) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22564229 0.87 ALDH1A1 (0.40) ALDH1A1L3MBTL1TDP1JMJD6TSHR
SCHEMBL22564284 0.86 ALDH1A1 (0.42) ALDH1A1L3MBTL1KMT2AATMTDP1

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed