SCHEMBL6258392

SCHEMBL6258392

O=C(NCc1ccc(F)cc1)c1c(Cl)nsc1Cl

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 3/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 2/20 0.46
THRB P10828 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
LMNA P02545 2/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL7978455 0.81 TP53 (0.51) TP53L3MBTL1KMT2ASMN1; SMN2POLB
SCHEMBL6259715 0.80 FAAH (0.47) TP53L3MBTL1KMT2AATMSMN1; SMN2
SCHEMBL6257286 0.80 FAAH (0.46) TP53L3MBTL1KMT2AATMSMN1; SMN2
SCHEMBL6257282 0.79 FAAH (0.46) TP53L3MBTL1KMT2AATMSMN1; SMN2
SCHEMBL6362752 0.75 KMT2A (0.60) L3MBTL1KMT2AATMPOLBCYP1A2
SCHEMBL2128166 0.73 KMT2A (0.81) TP53L3MBTL1KMT2AATMSMN1; SMN2
SCHEMBL6257633 0.72 KMT2A (0.56) TP53L3MBTL1KMT2AATMSMN1; SMN2
SCHEMBL6077802 0.70 L3MBTL1 (0.77) L3MBTL1KMT2ASMN1; SMN2POLBCYP1A2
SCHEMBL6355362 0.70 POLB (0.72) TP53L3MBTL1KMT2ASMN1; SMN2POLB
SCHEMBL7311399 0.69 KMT2A (0.70) L3MBTL1KMT2ASMN1; SMN2POLBCYP1A2

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
WO-2005070889-A1 HERBICIDAL AMIDES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2005-08-04 WO disclosed