SCHEMBL3395976

SCHEMBL3395976

COCCCNc1cc(CCCOC)c2c3c(cccc13)C(=O)NC2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HTT P42858 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 3/20 0.40
USP2 O75604 2/20 0.40
LMNA P02545 2/20 0.40
THRB P10828 1/20 0.40
ALOX12 P18054 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
TYMS P04818 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 3/20 0.36
HPGD P15428 1/20 0.36
CDK4 P11802 2/20 0.35

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
SCHEMBL3393345 0.90 MAPT (0.39) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL3391206 0.89 MAPT (0.39) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL3395564 0.89 MAPT (0.41) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL8519239 0.86 POLB (0.46) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL7106163 0.81 POLB (0.43) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL9388054 0.79 POLB (0.38) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL10719295 0.74 TYMS (0.44) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL7763006 0.69 PTPRB (0.42) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL29576080 0.69 PTPRB (0.42) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL14463934 0.68 KMT2A (0.50) ALDH1A1HTTMEN1KMT2AMAPT

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-20100058837-A1 DEVICE HAVING MULTIPLE LIGHT SOURCES AND METHODS OF USE THE BANK OF NEW YORK MELLON TRUST COMPANY, N.A. 2010-03-11 US disclosed
US-20080218998-A1 DEVICE HAVING MULTIPLE LIGHT SOURCES AND METHODS OF USE IDQ HOLDINGS, INC. 2008-09-11 US disclosed
US-5279967-A Using fluorophore label NALCO CHEMICAL COMPANY (US) 1994-01-18 US disclosed