SCHEMBL3199339

SCHEMBL3199339

O=C(Oc1cccc2cc(O)ccc12)c1ccc2cc(O)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.54
DYRK1A Q13627 1/20 0.54
DYRK1B Q9Y463 1/20 0.54
ESR1 P03372 8/20 0.49
KMT2A Q03164 7/20 0.49
SLC2A1 P11166 1/20 0.49
SLC2A4 P14672 1/20 0.49
MEN1 O00255 6/20 0.48
ALOX5 P09917 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PTGES O14684 1/20 0.46
ESR2 Q92731 6/20 0.45
POLB P06746 1/20 0.45
JAK2 O60674 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL28022689 0.93 ALOX5 (0.56) CLK1DYRK1ADYRK1BESR1KMT2A
SCHEMBL767398 0.91 ESR1 (0.49) CLK1DYRK1ADYRK1BESR1KMT2A
SCHEMBL10630235 0.84 ESR1 (0.53) ESR1KMT2AMEN1ALOX5NPC1
SCHEMBL4596186 0.83 ALOX5 (0.62) ESR1KMT2AMEN1ALOX5RAB9A
SCHEMBL28886219 0.82 ALOX5 (0.50) ESR1KMT2AMEN1ALOX5NPC1
SCHEMBL8756192 0.81 SLC2A1 (0.61) CLK1DYRK1ADYRK1BESR1KMT2A
SCHEMBL8756174 0.81 ESR1 (0.51) ESR1KMT2ASLC2A1SLC2A4MEN1
SCHEMBL16660338 0.81 KMT2A (0.49) CLK1DYRK1ADYRK1BESR1KMT2A
SCHEMBL28373149 0.81 ALOX5 (0.49) ESR1KMT2AMEN1ALOX5NPC1
SCHEMBL10921870 0.80 ALOX5 (0.66) ESR1KMT2ASLC2A1SLC2A4MEN1

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
CN-101175836-B Compounds comprising 2, 6-naphthyl groups BASF SE (DE) 2013-04-03 CN disclosed
US-7670505-B2 Compounds comprising 2,6-naphthyl groups BASF AKTIENGESELLSCHAFT (DE) 2010-03-02 US disclosed
US-20080221289-A1 Compounds Comprising 2,6-Naphthyl Groups BASF AKTIENGESELLSCHAFT (DE) 2008-09-11 US disclosed
CN-101175836-A Compounds comprising 2, 6-naphthyl groups BASF AG (DE) 2008-05-07 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221289-A1 Compounds Comprising 2,6-Naphthyl Groups SCO2, MT-CO1, CBR1 CLK1 3956/4885DYRK1A 4034/4885DYRK1B 4276/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.