SCHEMBL11248160

SCHEMBL11248160

CCc1ccccc1N(Cn1cncn1)C(=O)C(C)Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 1/20 0.38
CYP19A1 P11511 2/20 0.38
GAA P10253 1/20 0.37
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MC4R P32245 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 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
SCHEMBL10898673 0.89 MAPT (0.40) KMT2AMEN1MAPTCYP19A1GAA
SCHEMBL10674513 0.88 KMT2A (0.41) KMT2AMEN1MAPTCYP19A1TSHR
SCHEMBL10990810 0.84 KMT2A (0.46) KMT2AMEN1CYP19A1TSHRHSP90AA1
SCHEMBL10344940 0.83 TSHR (0.39) KMT2AMEN1TSHRHSD17B10MC4R
Hydrochloric Acid SCHEMBL10900071 0.82 TSHR (0.38) KMT2AMEN1TSHRHSD17B10MC4R
SCHEMBL10672451 0.81 MEN1 (0.36) KMT2AMEN1MAPTCYP19A1TSHR
SCHEMBL11265190 0.80 KDM4E (0.39) KMT2AMEN1MAPTGAATSHR
SCHEMBL10987307 0.79 CYP1A2 (0.38) KMT2AMEN1MAPT
SCHEMBL10989724 0.78 CYP1A2 (0.43) KMT2AMEN1MAPTHSP90AA1HDAC1
SCHEMBL10675265 0.77 TP53 (0.37) KMT2AMEN1GAATSHRHSD17B10

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-0010163-B1 N-DIAZOLYLALKYL-CHLOROACETANILIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1982-01-06 EP disclosed