SCHEMBL11333754

SCHEMBL11333754

COCN(C(=O)O)c1ccccc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ GABRA1 P14867 1/20 0.36
▸ GABRB2 P47870 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL11651042 0.84 ALDH1A1 (0.40) KMT2ALMNATP53MEN1GAA
SCHEMBL11463948 0.83 ALDH1A1 (0.46) KMT2ALMNAGABRA1GABRB2MEN1
SCHEMBL11653803 0.82 MAPK1 (0.39) KMT2ALMNAMEN1GAA
SCHEMBL11463874 0.81 SLC6A2 (0.40) KMT2ALMNATP53GABRA1GABRB2
SCHEMBL11482405 0.78 TSHR (0.41) KMT2ALMNAGABRA1GABRB2HSP90AA1
SCHEMBL15333351 0.76 MTNR1A (0.38) KMT2ALMNAMEN1
SCHEMBL78109 0.74 SIGMAR1 (0.42) KMT2ALMNATP53GABRA1GABRB2
SCHEMBL829849 0.73 LMNA (0.41) KMT2ALMNAGABRA1GABRB2HSP90AA1
SCHEMBL11798009 0.72 TP53 (0.48) LMNATP53GABRA1GABRB2
SCHEMBL11465497 0.71 TSHR (0.49) KMT2ALMNAMEN1

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-RE30578-E PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1981-04-14 — — US disclosed
US-4093447-A N-Arylcarbamic acid esters and plant growth regulant compositions and methods BAYER AKTIENGESELLSCHAFT (DT) 1978-06-06 — — US disclosed
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