SCHEMBL9557532

SCHEMBL9557532

CC(N(C(=O)c1ccccc1Br)N(C)C(=O)c1ccc(NC(N)=O)cc1)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ ALDH1A1 P00352 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ SIRT2 Q8IXJ6 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ KIF11 P52732 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ HDAC3 O15379 3/20 0.34
▸ HDAC4 P56524 3/20 0.34
▸ HDAC1 Q13547 3/20 0.34
▸ HDAC7 Q8WUI4 3/20 0.34
▸ HDAC2 Q92769 3/20 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
SCHEMBL9557538 0.87 MAPT (0.40) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9877608 0.81 MEN1 (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL10780929 0.81 KMT2A (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9824746 0.65 POLB (0.46) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9557914 0.65 HPGD (0.49) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9557612 0.61 HPGD (0.42) MEN1KMT2ARAB9AALDH1A1MAPT
SCHEMBL25247000 0.61 HPGD (0.57) NPC1RAB9AALDH1A1MAPTHPGD
SCHEMBL11600504 0.61 HPGD (0.61) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL5644991 0.60 HPGD (0.53) MEN1KMT2AALDH1A1HPGDGAA
SCHEMBL31479876 0.60 HPGD (0.51) MEN1KMT2AALDH1A1HPGDLMNA

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-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 — — US disclosed
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 — — EP disclosed
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