SCHEMBL10836723

SCHEMBL10836723

CP(C)(=S)Oc1c(Cl)cc(Cl)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
CYP1A2 P05177 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
CYP2C19 P33261 2/20 0.44
NPSR1 Q6W5P4 3/20 0.43
CYP2A6 P11509 2/20 0.37
ALDH1A1 P00352 7/20 0.34
KDM4E B2RXH2 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPK1 P28482 1/20 0.34
SLC2A1 P11166 1/20 0.33
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
HTT P42858 3/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HSD11B1 P28845 1/20 0.32

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
SCHEMBL11671121 0.78 TDP1 (0.39) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL554382 0.75 MEN1 (0.48) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL23387016 0.75 ALDH1A1 (0.58) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL18973592 0.68 KMT2A (0.55) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL7461874 0.68 MAPT (0.41) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL23387017 0.67 MAPT (0.43) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL68441 0.65 MAPT (0.55) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL6474548 0.64 MAPT (0.41) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL21623594 0.63 CYP1A2 (0.50) MAPTCYP1A2MEN1KMT2ACYP2C19
SCHEMBL1341460 0.63 MAPT (0.50) MAPTCYP1A2MEN1KMT2ACYP2C19

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-4605431-A ANTIDOTES FOR THIOLCARBAMATE HERBICIDES; PLANT SAFENING AGENTS MONSANTO COMPANY (US) 1986-08-12 US disclosed
US-4507143-A REDUCE INJURY TO CROPS MONSANTO COMPANY (US) 1985-03-26 US disclosed