SCHEMBL16107888

SCHEMBL16107888

Nc1cc2cccc(N)c2c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
HPGD P15428 6/20 0.54
HSD17B10 Q99714 4/20 0.54
TSHR P16473 3/20 0.54
CYP3A4 P08684 3/20 0.54
KEAP1 Q14145 2/20 0.54
HPRT1 P00492 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP1A2 P05177 3/20 0.45
ACHE P22303 2/20 0.45
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
MAOA P21397 1/20 0.45
AHR P35869 1/20 0.45
THRB P10828 1/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
HTT P42858 1/20 0.44
RAD52 P43351 1/20 0.44
LMNA P02545 2/20 0.42

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
SCHEMBL16107775 0.83 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL23022691 0.83 HPRT1 (0.61) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL16107765 0.83 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL9058600 0.81 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL16107486 0.80 ALDH1A1 (0.59) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL825325 0.77 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL31158232 0.77 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL3630203 0.77 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL16194308 0.77 ALDH1A1 (0.60) ALDH1A1HPGDHSD17B10TSHRCYP3A4
SCHEMBL11691006 0.77 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10TSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676907-B2 Methods and systems of graft polymerization on a functionalized substrate ASPEN RESEARCH CORPORATION (US) 2017-06-13 US disclosed
US-20160168331-A1 METHODS AND SYSTEMS OF GRAFT POLYMERIZATION ON A FUNCTIONALIZED SUBSTRATE JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2016-06-16 US disclosed
US-9267009-B2 Methods and systems of graft polymerization on a functionalized substrate ASPEN RESEARCH CORPORATION (US) 2016-02-23 US disclosed
US-20140296366-A1 METHODS AND SYSTEMS OF GRAFT POLYMERIZATION ON A FUNCTIONALIZED SUBSTRATE ASPEN RESEARCH CORPORATION (US) 2014-10-02 US disclosed
CN-103906775-A Methods and systems of graft polymerization on functionalized substrate ASPEN RES CORP 2014-07-02 CN disclosed