SCHEMBL11659986

SCHEMBL11659986

CCc1cccc(CC)c1N(CC(=O)N(C)O)C(=O)CCl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.62
TDP1 Q9NUW8 2/20 0.59
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
NR1I2 O75469 1/20 0.57
ALDH1A1 P00352 9/20 0.53
CYP3A4 P08684 1/20 0.53
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
PAX8 Q06710 4/20 0.38
JAK2 O60674 2/20 0.38
GPX4 P36969 1/20 0.37
HTT P42858 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
GLA P06280 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL11659033 0.92 TP53 (0.66) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL11657353 0.87 TP53 (0.61) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL11658557 0.85 TP53 (0.63) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL3695063 0.84 TP53 (0.66) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL131683 0.84 TP53 (0.66) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL11653949 0.84 TP53 (0.66) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL27976189 0.84 TP53 (0.69) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL11655815 0.83 ALDH1A1 (0.51) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL11413459 0.83 TP53 (0.64) TP53TDP1KMT2AMEN1NR1I2
SCHEMBL9614029 0.82 TP53 (0.71) TP53TDP1KMT2AMEN1NR1I2

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
US-4126440-A Hydroxamic acid derivatives for regulating plant growth CIBA-GEIGY CORPORATION (US) 1978-11-21 US disclosed