SCHEMBL8748635

SCHEMBL8748635

CC(=O)C(Cc1ccc(C)cc1)=[N+]=[N-]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.43
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
RAB9A P51151 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
FFAR1 O14842 1/20 0.38
CYP2C19 P33261 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
SCHEMBL8749069 0.83 CES1 (0.48) CTBP2KMT2AMEN1L3MBTL1LMNA
SCHEMBL8748889 0.81 HTT (0.53) CTBP2KMT2AMEN1NPC1SMN1; SMN2
SCHEMBL8749097 0.80 CTBP2 (0.49) CTBP2L3MBTL1NPC1ALDH1A1
SCHEMBL8749134 0.80 L3MBTL1 (0.51) CTBP2RAB9AL3MBTL1NPC1HPGD
SCHEMBL81559 0.73 CTBP2 (0.53) CTBP2KMT2AMEN1RAB9AL3MBTL1
Water SCHEMBL28157653 0.71 CTBP2 (0.52) CTBP2KMT2AMEN1RAB9AL3MBTL1
SCHEMBL9513793 0.71 CTBP2 (0.47) CTBP2KMT2AMEN1RAB9AL3MBTL1
SCHEMBL4940818 0.71 L3MBTL1 (0.62) CTBP2KMT2AMEN1RAB9AL3MBTL1
SCHEMBL16835972 0.70 ALDH1A1 (0.48) CTBP2KMT2AMEN1RAB9AL3MBTL1
Acetone SCHEMBL2930477 0.70 CA2 (0.58) CTBP2KMT2ARAB9AL3MBTL1NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5627006-A ALKENYLOXY-SUBSTITUTED POLYVINYLPHENOLS, PHOTOSENSITIVE ACID GENERATOR WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-06 US disclosed
EP-0552548-B1 Resist material WAKO PURE CHEM IND LTD (JP) 1997-03-19 EP disclosed
EP-0552548-A1 Resist material WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1993-07-28 EP disclosed