SCHEMBL6322969

SCHEMBL6322969

CCCOC(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
LMNA P02545 4/20 0.51
HPGD P15428 2/20 0.51
SMN1; SMN2 Q16637 5/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPT P10636 3/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
POLB P06746 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL6332367 0.91 MEN1 (0.54) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6326485 0.91 MEN1 (0.54) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6324642 0.91 MEN1 (0.54) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6321973 0.91 LMNA (0.57) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6324678 0.91 SMN1; SMN2 (0.60) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6331862 0.90 ALDH1A1 (0.56) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6324631 0.90 ALDH1A1 (0.56) ALDH1A1HPGDSMN1; SMN2CA12CA1
SCHEMBL7599798 0.89 FBP1 (0.58) ALDH1A1LMNAHPGDSMN1; SMN2MAPT
SCHEMBL6725193 0.87 ALDH1A1 (0.59) ALDH1A1LMNAHPGDSMN1; SMN2CA12
SCHEMBL6331093 0.86 ALDH1A1 (0.58) ALDH1A1LMNAHPGDSMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed