SCHEMBL16518794

SCHEMBL16518794

CCOC(=O)c1ccccc1C1=C2C=CC(C)(N(C)C)C=C2Oc2cc(N(C)C)ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 6/20 0.33
▸ MAPT P10636 5/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HSD17B10 Q99714 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ ERN1 O75460 1/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ PRKCZ Q05513 1/20 0.32
▸ USP2 O75604 1/20 0.31

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
SCHEMBL16491631 0.87 USP2 (0.34) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL17448856 0.81 TSHR (0.34) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL15031010 0.76 SMN1; SMN2 (0.38) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL12093970 0.67 ALDH1A1 (0.36) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL13234516 0.66 MAOB (0.41) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL28166988 0.64 ALDH1A1 (0.50) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL3683272 0.62 TSHR (0.80) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL29617021 0.62 TSHR (0.80) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL11669735 0.61 TSHR (0.56) TSHRRAB9AMEN1KMT2AALDH1A1
SCHEMBL10045392 0.60 TSHR (0.54) TSHRRAB9AMEN1KMT2AALDH1A1

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-8963104-B2 Optical element for correcting color blindness NITTO DENKO CORPORATION (JP) 2015-02-24 — — US disclosed
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