SCHEMBL9128019

SCHEMBL9128019

O=C(Nc1cccc(-c2ccc(O)cc2)c1)OC1CCCCC1

nearest known ligand 0.83

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.83
▸ FAAH O00519 1/20 0.83
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ ITGB3 P05106 1/20 0.50
▸ ITGAV P06756 1/20 0.50
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ ENPP2 Q13822 1/20 0.44

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
SCHEMBL29633028 0.91 MGLL (1.00) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL4274165 0.91 MGLL (1.00) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL1147281 0.82 FAAH (0.75) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL12166518 0.82 FAAH (0.57) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL12166742 0.81 FAAH (0.77) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL10089336 0.79 MEN1 (0.70) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL9124415 0.78 MGLL (0.52) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL4965644 0.77 MEN1 (0.68) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL2576912 0.77 FAAH (0.76) MGLLFAAHMEN1KMT2ACYP1A2
SCHEMBL10192096 0.77 MEN1 (0.67) MGLLFAAHMEN1KMT2ACYP1A2

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
EP-0524419-B1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS (JP) 1995-09-06 — — EP disclosed
US-5391806-A A storage stable chromogens as color-developing agent or stabilizers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-02-21 — — US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 — — US disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 — — EP disclosed
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