SCHEMBL11437264

SCHEMBL11437264

CC(C)C(=NO)c1ccc(C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.43
▸ CA2 P00918 3/20 0.42
▸ CA1 P00915 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NOS3 P29474 2/20 0.40
▸ NOS1 P29475 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ CYP2A6 P11509 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA3 P07451 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ ABCC9 O60706 1/20 0.38
▸ KCNJ11 Q14654 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CTBP2 P56545 1/20 0.38

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
SCHEMBL11437225 0.81 USP2 (0.39) CA2CA1MEN1KMT2ACA12
SCHEMBL11313376 0.75 ALDH1A1 (0.46) MEN1KMT2AALDH1A1LMNAUSP2
SCHEMBL11313374 0.75 ALDH1A1 (0.46) MEN1KMT2AALDH1A1LMNAUSP2
SCHEMBL1237696 0.74 TRPA1 (0.44) CA2CA1MEN1KMT2AALDH1A1
SCHEMBL1237695 0.74 TRPA1 (0.44) CA2CA1MEN1KMT2AALDH1A1
SCHEMBL7700455 0.74 LMNA (0.56) GSK3BCA2CA1MEN1KMT2A
SCHEMBL11322817 0.74 HTT (0.43) GSK3BCA2CA1MEN1KMT2A
SCHEMBL11315381 0.74 MEN1 (0.53) CA2CA1MEN1KMT2AALDH1A1
SCHEMBL10340700 0.74 MEN1 (0.53) CA2CA1MEN1KMT2AALDH1A1
SCHEMBL11322821 0.74 HTT (0.43) GSK3BCA2CA1MEN1KMT2A

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
EP-0009865-A1 Process for the stereoselective synthesis of the E isomer of aryl alkyl oximes RHONE-POULENC INC. (US) 1980-04-16 — — EP disclosed
US-4158015-A Process for the stereoselective synthesis of the E isomer of aryl alkyl oximes MOBIL OIL CORPORATION (US) 1979-06-12 — — US disclosed
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