SCHEMBL6329992

SCHEMBL6329992

Cc1ccccc1OS(=O)(=O)c1ccccc1NC(=O)NS(=O)(=O)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 4/20 0.39
MRGPRX1 Q96LB2 3/20 0.39
MEN1 O00255 3/20 0.38
HPGD P15428 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TSHR P16473 1/20 0.38
HTR6 P50406 1/20 0.38
ESR1 P03372 1/20 0.37
GAA P10253 1/20 0.37
ESR2 Q92731 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.37
P2RX7 Q99572 1/20 0.36

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
SCHEMBL6321845 0.84 KDM4E (0.43) SMN1; SMN2KMT2AMRGPRX1MEN1HPGD
SCHEMBL6323995 0.81 TAS1R3 (0.42) SMN1; SMN2KMT2AMRGPRX1MEN1TSHR
SCHEMBL6324299 0.81 KMT2A (0.42) SMN1; SMN2KMT2AMRGPRX1MEN1TSHR
SCHEMBL6326717 0.80 MRGPRX1 (0.42) SMN1; SMN2KMT2AMRGPRX1MEN1TAS1R3
SCHEMBL6329861 0.78 KMT2A (0.39) SMN1; SMN2KMT2AMRGPRX1MEN1HTT
SCHEMBL29673590 0.75 KMT2A (0.55) SMN1; SMN2KMT2AMEN1CYP1A2CYP2C9
SCHEMBL22187534 0.75 KMT2A (0.55) SMN1; SMN2KMT2AMEN1CYP1A2CYP2C9
SCHEMBL26606010 0.73 GAA (0.52) SMN1; SMN2KMT2AMEN1HPGDCYP1A2
SCHEMBL22187187 0.72 GAA (0.48) SMN1; SMN2KMT2AMEN1CYP1A2CYP2C9
SCHEMBL7599829 0.71 KDM4E (0.41) SMN1; SMN2KMT2AMRGPRX1MEN1HPGD

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