SCHEMBL9125161

SCHEMBL9125161

Cc1cc(-c2ccc(Oc3ccc(-c4ccc(O)c(C)c4)c(NC(=O)Oc4ccccc4)c3)cc2NC(=O)Oc2ccccc2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ GAA P10253 3/20 0.41
▸ GLA P06280 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.41
▸ PORCN Q9H237 1/20 0.41
▸ MCL1 Q07820 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.38
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL9125379 0.86 ALDH1A1 (0.42) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9126625 0.85 THRA (0.44) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9126089 0.84 TRPV1 (0.51) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9125818 0.83 TRPV1 (0.50) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9125156 0.79 KMT2A (0.48) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9124995 0.78 MAPT (0.42) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9125372 0.76 KMT2A (0.47) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL21305450 0.76 KMT2A (0.54) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL6960305 0.73 GAA (0.56) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9126193 0.73 ALDH1A1 (0.40) KMT2AMEN1ALDH1A1KDM4EMAPT

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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