SCHEMBL11264198

SCHEMBL11264198

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

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.67
ALDH1A1 P00352 5/20 0.67
TDP1 Q9NUW8 3/20 0.67
CYP3A4 P08684 1/20 0.67
NR1I2 O75469 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 1/20 0.39
OPRM1 P35372 3/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
PAX8 Q06710 3/20 0.38
GPX4 P36969 1/20 0.38
TSHR P16473 1/20 0.38
JAK2 O60674 2/20 0.36
HTT P42858 1/20 0.36
ESR1 P03372 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
SCHEMBL11698654 0.91 TP53 (0.64) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11260320 0.90 ALDH1A1 (0.52) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL10858355 0.85 TP53 (0.74) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11255644 0.85 TP53 (0.63) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL8204724 0.83 ALDH1A1 (0.71) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11122093 0.83 TP53 (0.71) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11867705 0.83 TP53 (0.50) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11865711 0.82 ALDH1A1 (0.49) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11702004 0.82 TP53 (0.52) TP53ALDH1A1TDP1CYP3A4NR1I2
SCHEMBL11258186 0.82 ALDH1A1 (0.49) TP53ALDH1A1TDP1CYP3A4NR1I2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4326077-A HERBICIDE AND PLANT GROWTH REGULATOR CHEVRON RESEARCH COMPANY (US) 1982-04-20 US disclosed
US-4260410-A Herbicidal and plant-growth-regulating N-haloacetylphenylamino carbonyl oximes CHEVRON RESEARCH COMPANY (US) 1981-04-07 US disclosed
US-4174210-A Herbicidal and plant-growth regulating N-haloacetylphenylamino carbonyl oximes CHEVRON RESEARCH COMPANY (US) 1979-11-13 US disclosed