SCHEMBL10730944

SCHEMBL10730944

O=C(O)c1nc(C(Cl)(Cl)Cl)n(-c2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.67
POLB P06746 2/20 0.51
NPY5R Q15761 9/20 0.44
NOTUM Q6P988 2/20 0.43
KMO O15229 1/20 0.43
ALKBH5 Q6P6C2 1/20 0.43
CTSK P43235 1/20 0.42

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
SCHEMBL10729860 0.86 KMT2A (0.50) KMT2APOLBNPY5R
SCHEMBL4093594 0.84 KDM4E (0.48) KMT2APOLBNOTUMKMO
SCHEMBL10733025 0.84 NPY5R (0.56) KMT2ANPY5R
SCHEMBL10729471 0.83 KMT2A (0.47) KMT2APOLBNPY5R
SCHEMBL4017916 0.82 SMN1; SMN2 (0.58) KMT2A
SCHEMBL17908037 0.82 KMT2A (0.73) KMT2APOLBNPY5RNOTUM
SCHEMBL31175294 0.82 KMT2A (0.73) KMT2APOLBNPY5RNOTUM
SCHEMBL10846668 0.82 KMT2A (0.48) KMT2APOLBNPY5RNOTUM
SCHEMBL4100012 0.81 KMT2A (0.54) KMT2APOLBNPY5R
SCHEMBL21816430 0.77 SMN1; SMN2 (0.58) KMT2APOLB

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
US-4639266-A Plant protection agents based on 1,2,4-triazole derivatives and also new derivatives of 1,2,4-triazole HOECHST AKTIENGESELLSCHAFT (DE) 1987-01-27 US disclosed
EP-0174562-A2 Plant protecting agents based on 1,2,4 - triazole derivatives as well as 1,2,4-triazole derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1986-03-19 EP disclosed