SCHEMBL27520697

SCHEMBL27520697

Clc1cccc(-c2cnco2)n1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.55
NOTUM Q6P988 1/20 0.47
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
MAP4K4 O95819 1/20 0.42
PTK2 Q05397 1/20 0.41
LTA4H P09960 1/20 0.40
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
HTR1A P08908 2/20 0.36
KEAP1 Q14145 1/20 0.36
ADORA2A P29274 1/20 0.35
RHEB Q15382 1/20 0.35
IDH1 O75874 1/20 0.34

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
SCHEMBL2150755 0.86 ROCK2 (0.69) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL2151325 0.84 ROCK2 (0.72) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL16265336 0.78 ROCK2 (0.55) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL14880372 0.78 ROCK2 (0.55) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL2225643 0.78 ROCK2 (0.55) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL17704392 0.75 ROCK2 (0.56) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL16159258 0.75 ROCK2 (0.56) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL10142588 0.75 ROCK2 (0.60) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL19365501 0.74 ROCK2 (0.51) ROCK2NOTUMMEN1KMT2ACYP11B1
SCHEMBL6978343 0.74 ROCK2 (0.51) ROCK2NOTUMMEN1KMT2ACYP11B1

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
CN-1245401-C 6-aryl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2006-03-15 CN disclosed
CN-1551876-A 6-aryl-4-aminopicolinates and their use as herbicides �ݶ�ũ�����޹�˾ 2004-12-01 CN disclosed