SCHEMBL29200409

SCHEMBL29200409

O=C(Nc1ccccc1)N(CCl)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.70
MEN1 O00255 3/20 0.70
HSD17B10 Q99714 2/20 0.60
USP2 O75604 1/20 0.60
THRB P10828 1/20 0.55
MAPT P10636 3/20 0.51
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
PAX8 Q06710 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALOX15 P16050 1/20 0.50
MITF O75030 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 3/20 0.48
TP53 P04637 2/20 0.45
EPHX1 P07099 1/20 0.45
TSHR P16473 1/20 0.45
EPHX2 P34913 1/20 0.45

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
SCHEMBL3483338 0.82 MEN1 (0.70) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL4304223 0.82 MEN1 (1.00) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL10841580 0.81 MEN1 (0.68) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL4554499 0.78 HSD17B10 (0.60) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL11429178 0.78 MEN1 (0.64) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL17932837 0.77 USP2 (0.63) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL5819195 0.77 KMT2A (0.57) KMT2AMEN1HSD17B10USP2THRB
SCHEMBL11287043 0.77 ALDH1A1 (0.58) KMT2AMEN1ALDH1A1SMN1; SMN2NPC1
SCHEMBL9749098 0.76 MEN1 (0.69) KMT2AMEN1HSD17B10USP2ALDH1A1
SCHEMBL20016685 0.76 MEN1 (0.79) KMT2AMEN1HSD17B10USP2THRB

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
CN-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 CN disclosed