SCHEMBL7170719

SCHEMBL7170719

Clc1ccccc1COc1ccc(OCc2ccccc2Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.71
MAOB P27338 4/20 0.69
MAOA P21397 1/20 0.69
MAPT P10636 2/20 0.59
TP53 P04637 1/20 0.59
GAA P10253 1/20 0.59
IDO1 P14902 2/20 0.59
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
HTT P42858 1/20 0.58
RAD52 P43351 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
LMNA P02545 2/20 0.56
POLB P06746 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
RAB9A P51151 2/20 0.56
NPC1 O15118 1/20 0.56
PTPN1 P18031 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55

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
SCHEMBL9812484 0.93 NR4A2 (0.69) NR4A2MAOBMAOAMAPTTP53
SCHEMBL3618405 0.92 MAPT (0.70) NR4A2MAOBMAOAMAPTTP53
SCHEMBL11849613 0.90 NR4A2 (0.66) NR4A2MAOBMAOAMAPTTP53
SCHEMBL6408450 0.90 NR4A2 (0.61) NR4A2MAOBMAOAMAPTTP53
SCHEMBL13483791 0.90 MAOB (0.64) NR4A2MAOBMAOAMAPTTP53
SCHEMBL11093923 0.90 MAOB (0.69) NR4A2MAOBMAOAMAPTTP53
SCHEMBL29001619 0.86 SMN1; SMN2 (0.66) NR4A2MAOBMAOAMAPTTP53
SCHEMBL21762 0.86 NR4A2 (0.66) NR4A2MAOBMAOAMAPTTP53
SCHEMBL920476 0.86 NR4A2 (0.57) NR4A2MAOBMAOAMAPTTP53
SCHEMBL13761557 0.86 MAOB (0.59) NR4A2MAOBMAOAMAPTTP53

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579829-B2 Aromatic sulfonamide compound MITSUI CHEMICALS, INC. (JP) 2003-06-17 US disclosed
EP-0664292-B1 A phtalide compound and a near infrared absorber and a recording material each comprising the same compound YAMAMOTO CHEMICALS INC (JP) 2002-06-19 EP disclosed
US-20010036903-A1 Developer composition and heat sensitive recording material MITSUI CHEMICALS, INC. (JP) 2001-11-01 US disclosed
EP-1138517-A2 Developer composition and heat sensitive recording material Mitsui Chemicals, Inc. (JP) 2001-10-04 EP disclosed
US-5627287-A COLORLESS YAMAMOTO CHEMICALS, INC. (JP) 1997-05-06 US disclosed
EP-0534257-B1 Salicylic acid derivatives, the process for preparing the same and the heat-sensitive recording materials comprising thereof MITSUI TOATSU CHEMICALS (JP) 1997-03-12 EP disclosed
EP-0524419-B1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS (JP) 1995-09-06 EP disclosed
EP-0664292-A1 A phtalide compound and a near infrared absorber and a recording material each comprising the same compound YAMAMOTO CHEMICALS, INC. (JP) 1995-07-26 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-5306688-A Color-forming, electron donating compound and electron accepting compound; storage stability of uncolored portion MITSUI TOATSU CHEMICALS, INC. (JP) 1994-04-26 US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 US disclosed
EP-0534257-A1 Salicylic acid derivatives, the process for preparing the same and the heat-sensitive recording materials comprising thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 EP disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 EP disclosed