SCHEMBL21551977

SCHEMBL21551977

CC(=NO)C(=O)c1ccc2c(c1)C(C)(C)c1cc(Sc3ccccc3)c(Sc3ccccc3)cc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ RXRA P19793 2/20 0.36
▸ RXRB P28702 2/20 0.36
▸ RXRG P48443 2/20 0.36
▸ PDK2 Q15119 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ GAA P10253 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RARB P10826 1/20 0.30
▸ RARG P13631 1/20 0.30
▸ SIRT1 Q96EB6 1/20 0.30
▸ ICAM1 P05362 1/20 0.30
▸ SELE P16581 1/20 0.30
▸ EZH2 Q15910 1/20 0.30
▸ GLA P06280 1/20 0.30

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
SCHEMBL21551952 0.88 HPGD (0.44) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL21551916 0.84 POLB (0.42) MAPTSMN1; SMN2POLBPDK2
SCHEMBL18235871 0.81 POLB (0.46) MAPTSMN1; SMN2POLBPDK2
SCHEMBL21560535 0.80 SMN1; SMN2 (0.39) MAPTSMN1; SMN2ALDH1A1HPGDRXRA
SCHEMBL21560521 0.77 MAPT (0.33) MAPTALDH1A1HPGDRXRARXRB
SCHEMBL21551828 0.76 HPGD (0.42) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL21552102 0.73 ALDH1A1 (0.38) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL21551946 0.71 CYP26A1 (0.35) ALDH1A1HPGDRXRARXRBRXRG
SCHEMBL18012798 0.70 KMT2A (0.47) MAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL16271513 0.69 PDK2 (0.47) PDK2

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
WO-2019216600-A1 NOVEL OXIME ESTER COMPOUND AND PHOTORESIST COMPOSITION COMPRISING SAME 주식회사 트리엘 (KR) 2019-11-14 — — WO disclosed
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