SCHEMBL30434705

SCHEMBL30434705

Oc1ccccc1Oc1ncc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
LMNA P02545 3/20 0.57
TSHR P16473 2/20 0.57
CYP2C9 P11712 2/20 0.57
APEX1 P27695 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
LIPE Q05469 4/20 0.48
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 2/20 0.44
BCHE P06276 1/20 0.41
MAPT P10636 2/20 0.41
NR1I2 O75469 1/20 0.41

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
SCHEMBL11065229 0.89 MAPK1 (0.57) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL2476407 0.88 LMNA (0.67) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL10997903 0.84 CYP1A2 (0.44) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL28479796 0.84 POLB (0.43) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL10997440 0.81 CYP1A2 (0.71) LMNASMN1; SMN2LIPECYP1A2CYP3A4
SCHEMBL11135278 0.76 GAA (0.62) LMNATSHRSMN1; SMN2CYP1A2CYP3A4
SCHEMBL10644755 0.74 LMNA (0.57) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL10482267 0.74 MAPK1 (0.50) MAPK1LMNATSHRCYP2C9APEX1
SCHEMBL11135267 0.73 KMT2A (0.48) LMNATSHRSMN1; SMN2LIPEKMT2A
SCHEMBL5647172 0.73 MAPK1 (1.00) MAPK1LMNATSHRCYP2C9APEX1

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-116217470-A Aryloxy-phenoxy compound and application thereof as herbicide 沈阳中化农药化工研发有限公司 2023-06-06 CN disclosed