SCHEMBL5586068

SCHEMBL5586068

Nc1ccc(Oc2ccnnn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
TDP1 Q9NUW8 4/20 0.48
CYP3A4 P08684 2/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
APAF1 O14727 1/20 0.46
MAOA P21397 2/20 0.42
MAPT P10636 4/20 0.41
TEAD4 Q15561 1/20 0.41
MAOB P27338 1/20 0.41
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
MITF O75030 1/20 0.39
GAA P10253 1/20 0.39
GFER P55789 1/20 0.39
NLRP1 Q9C000 1/20 0.39
NOD2 Q9HC29 1/20 0.39
BCAT2 O15382 1/20 0.39

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
SCHEMBL5686802 0.81 MEN1 (0.48) MEN1KMT2AGAAMAPK1PARP10
SCHEMBL108194 0.80 BCAT2 (0.50) ALDH1A1TDP1TSHRMEN1KMT2A
SCHEMBL13302352 0.79 ALDH1A1 (0.62) ALDH1A1TDP1CYP3A4TSHRMEN1
SCHEMBL26556 0.79 MEN1 (0.31) ALDH1A1MEN1KMT2A
SCHEMBL4797479 0.77 MEN1 (0.50) ALDH1A1TDP1CYP3A4TSHRMEN1
SCHEMBL28026591 0.74 HAO1 (0.50) ALDH1A1TDP1MEN1KMT2AMAOA
SCHEMBL6803812 0.72 BCAT2 (0.71) ALDH1A1TDP1CYP3A4TSHRMEN1
SCHEMBL5687361 0.72 CYP1A2 (0.38) ALDH1A1TDP1CYP3A4TSHRMEN1
SCHEMBL3172913 0.70
SCHEMBL1895117 0.69 MEN1 (0.50) ALDH1A1TDP1CYP3A4TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070270562-A1 SILOXANE-MODIFIED HYPERBRANCHED POLYIMIDE NATIONAL UNIVERSITY CORPORATION NAGOYA INSTITUTE OF TECHNOLOGY (JP) 2007-11-22 US claimed
CN-103360560-B Coating material 株式会社尼德克 2017-06-09 CN disclosed
CN-103360560-A Multi-branched-chain high-refractive-index material and multi-branched-chain high-refractive-index material of organic-inorganic compound NIDEK KK 2013-10-23 CN disclosed
US-20070270562-A1 SILOXANE-MODIFIED HYPERBRANCHED POLYIMIDE NATIONAL UNIVERSITY CORPORATION NAGOYA INSTITUTE OF TECHNOLOGY (JP) 2007-11-22 US disclosed