SCHEMBL20099166

SCHEMBL20099166

CCC(C)C1C(=O)c2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC25A5 P05141 2/20 0.46
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
S100A4 P26447 3/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 4/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 3/20 0.39
TP53 P04637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HTR2B P41595 1/20 0.39
CDC25B P30305 2/20 0.39
PIM1 P11309 1/20 0.38
ACE P12821 1/20 0.37
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
HBB P68871 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
SCHEMBL16271244 0.78 MEN1 (0.48) SLC25A5MEN1KMT2AS100A4POLB
SCHEMBL6672597 0.77 TSHR (0.42) MEN1KMT2APOLBCYP1A2BCHE
SCHEMBL21966584 0.76 CYP1B1 (0.39) MEN1KMT2ALMNACYP3A4ALDH1A1
SCHEMBL11698893 0.69 SLC25A5 (0.57) SLC25A5MEN1KMT2AS100A4POLB
SCHEMBL14427580 0.69 MEN1 (0.55) SLC25A5MEN1KMT2AS100A4POLB
SCHEMBL8365427 0.69 ALDH1A1 (0.58) SLC25A5MEN1KMT2AS100A4POLB
SCHEMBL4195577 0.68 ALDH1A1 (0.43) MEN1KMT2APOLBMAPTLMNA
SCHEMBL30366625 0.68 ALDH1A1 (0.43) MEN1KMT2APOLBMAPTLMNA
SCHEMBL26146649 0.68 SLC25A5 (0.47) SLC25A5MEN1KMT2AS100A4POLB
SCHEMBL21935663 0.67 ACE (0.41) SLC25A5S100A4POLBCDC25BACE

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
US-9960294-B2 Highly fluorescent and photo-stable chromophores for wavelength conversion NITTO DENKO CORPORATION (JP) 2018-05-01 US disclosed