SCHEMBL9125277

SCHEMBL9125277

O=C(Nc1ccccc1)Oc1ccc(C(=O)Oc2ccc(O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.66
▸ MEN1 O00255 5/20 0.66
▸ ALDH1A1 P00352 7/20 0.60
▸ GAA P10253 4/20 0.60
▸ HTT P42858 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ MAPT P10636 6/20 0.59
▸ KDM4E B2RXH2 4/20 0.59
▸ THRB P10828 3/20 0.59
▸ GFER P55789 2/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ GLA P06280 1/20 0.59
▸ BLM P54132 1/20 0.59
▸ CASP6 P55212 1/20 0.59
▸ USP2 O75604 1/20 0.57
▸ HPGD P15428 2/20 0.56
▸ PARP10 Q53GL7 1/20 0.51
▸ RAD51 Q06609 1/20 0.51
▸ LMNA P02545 1/20 0.51

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
SCHEMBL9127303 0.96 KMT2A (0.61) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL9124260 0.95 ALDH1A1 (0.63) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL9127234 0.92 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL9126246 0.86 ALDH1A1 (0.66) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL9122287 0.85 CYP1A2 (0.56) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL9125722 0.84 ALDH1A1 (0.75) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL5162040 0.84 PARP10 (0.70) KMT2AMEN1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL21630436 0.82 ALDH1A1 (0.70) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL6629567 0.82 RAB9A (0.68) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL455541 0.82 PARP10 (0.61) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT

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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