SCHEMBL11326656

SCHEMBL11326656

CC(C)(C)N(C(=O)CCl)C(C)(C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.46
▸ KMT2A Q03164 8/20 0.46
▸ NPC1 O15118 7/20 0.46
▸ RAB9A P51151 7/20 0.46
▸ HTT P42858 7/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 5/20 0.44
▸ LMNA P02545 3/20 0.44
▸ TP53 P04637 1/20 0.44
▸ PAX8 Q06710 6/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MEN1 O00255 5/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ GLA P06280 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ JAK2 O60674 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL9615134 0.83 CYP2C19 (0.42) ALDH1A1KMT2AHTTPOLBSMN1; SMN2
SCHEMBL11330728 0.78 MAPT (0.44) ALDH1A1KMT2APOLBSMN1; SMN2HIF1A
SCHEMBL16153654 0.74 PIN1 (0.34) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL11750806 0.72 MAPT (0.55) ALDH1A1KMT2AHTTPOLBHIF1A
SCHEMBL23343791 0.71 OPRM1 (0.47) ALDH1A1KMT2ANPC1RAB9APOLB
SCHEMBL8733650 0.70 ESR2 (0.47) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL4447460 0.70 KMT2A (0.57) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL8906002 0.69 MEN1 (0.69) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL11317510 0.69 AKT1 (0.39) ALDH1A1KMT2APOLBLMNAHIF1A
SCHEMBL7273963 0.69 KMT2A (0.46) ALDH1A1KMT2ANPC1RAB9AHTT

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
US-4288244-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-09-08 — — US disclosed
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