SCHEMBL9633669

SCHEMBL9633669

CCC(=O)N1CC(=Cc2ccc(N(C)C)cc2)C(=O)C(=Cc2ccc(N(C)C)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
MITF O75030 1/20 0.53
NSD2 O96028 1/20 0.51
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.50
LMNA P02545 2/20 0.50
MDM2 Q00987 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MCOLN3 Q8TDD5 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ACHE P22303 4/20 0.48
F2 P00734 3/20 0.47
F10 P00742 2/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL9634055 0.90 MITF (0.57) CYP1A2MITFNSD2MAPTMEN1
SCHEMBL8373640 0.85 CYP1A2 (0.59) CYP1A2NSD2MAPTMEN1KMT2A
SCHEMBL9632514 0.84 MAPT (0.72) CYP1A2MITFNSD2MAPTMEN1
SCHEMBL31237750 0.83 DRD3 (0.59) MITFMAPTMEN1KMT2ARAB9A
SCHEMBL17055082 0.81 CYP1A2 (0.55) CYP1A2MITFNSD2MAPTMEN1
SCHEMBL8376284 0.80 CYP1A2 (0.60) CYP1A2NSD2MAPTMEN1KMT2A
Dimethylamine SCHEMBL9633673 0.80 ALDH1A1 (0.65) CYP1A2MITFMAPTMEN1KMT2A
SCHEMBL8373623 0.79 MAPT (0.58) CYP1A2MITFNSD2MAPTMEN1
SCHEMBL8372688 0.78 CYP1A2 (0.66) CYP1A2MITFNSD2MAPTMEN1
SCHEMBL17054697 0.78 CYP1A2 (0.66) CYP1A2MITFNSD2MAPTMEN1

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