SCHEMBL28190202

SCHEMBL28190202

O=C(Oc1cc(Cl)cc(Cl)c1)C1CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.52
▸ HTT P42858 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ ELANE P08246 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ POLB P06746 2/20 0.44
▸ HPGD P15428 2/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ NOTUM Q6P988 1/20 0.39

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
SCHEMBL28317782 0.84 KMT2A (0.41) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL21533989 0.84 ATM (0.45) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL27779967 0.82 POLB (0.58) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL4544891 0.80 SMN1; SMN2 (0.68) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL697614 0.80 SMN1; SMN2 (0.68) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL8654255 0.78 POLB (0.57) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL11823665 0.76 KMT2A (0.83) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL28681477 0.76 KMT2A (0.52) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL28681472 0.76 KMT2A (0.52) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL5474238 0.76 AKR1C3 (0.47) KMT2AHTTSMN1; SMN2TDP1ELANE

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
CN-107734969-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2018-02-23 — — CN disclosed
CN-107529748-A Molecule with desinsection effectiveness, and relative intermediate, composition and method 美国陶氏益农公司 2018-01-02 — — CN disclosed
CN-107466291-A Molecule with desinsection effectiveness, and relative intermediate, composition and method 美国陶氏益农公司 2017-12-12 — — CN disclosed
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