SCHEMBL9633176

SCHEMBL9633176

CCN1CC(=Cc2ccc(N(CC)CC)cc2C)C(=O)C(=Cc2ccc(N(CC)CC)cc2C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.42
MAPT P10636 7/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
LMNA P02545 4/20 0.42
MAPK1 P28482 4/20 0.42
NPC1 O15118 3/20 0.42
HTT P42858 3/20 0.42
RAB9A P51151 3/20 0.42
ATM Q13315 3/20 0.42
GAA P10253 3/20 0.42
HSP90AA1 P07900 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MDM4 O15151 1/20 0.42
JAK2 O60674 1/20 0.42
XBP1 P17861 1/20 0.42
MDM2 Q00987 1/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.40

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
SCHEMBL9633148 0.88 PTGS2 (0.50) ALDH1A1MAPTSMN1; SMN2MAPK1NPC1
SCHEMBL1416417 0.85 S100B (0.45) ALDH1A1MAPTSMN1; SMN2MAPK1NPC1
SCHEMBL1416418 0.85 S100B (0.45) ALDH1A1MAPTSMN1; SMN2MAPK1NPC1
SCHEMBL11319345 0.83 ACHE (0.49) ALDH1A1MAPTSMN1; SMN2LMNANPC1
SCHEMBL9632481 0.83 S100B (0.43) ALDH1A1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL9342036 0.83 ACHE (0.49) ALDH1A1MAPTSMN1; SMN2LMNANPC1
SCHEMBL9631742 0.82 S100B (0.42) ALDH1A1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL8377306 0.80 ALDH1A1 (0.58) ALDH1A1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL10477943 0.78 PTGS2 (0.55) ALDH1A1MAPTSMN1; SMN2LMNANPC1
SCHEMBL30298453 0.78 PTGS2 (0.55) ALDH1A1MAPTSMN1; SMN2LMNANPC1

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
EP-0295044-B1 PHOTOINITIATOR AND PHOTOPOLYMERIZABLE COMPOSITION USING THE SAME Hitachi Chemical Co., Ltd. (JP) 1992-04-22 EP disclosed
US-4987057-A HIGH SENSITIVITY TO VISIBLE LIGHT RAYS HITACHI CHEMICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0295044-A2 Photoinitiator and photopolymerizable composition using the same Hitachi Chemical Co., Ltd. (JP) 1988-12-14 EP disclosed