SCHEMBL1395602

SCHEMBL1395602

Cc1ccc(COCCNS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.79
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
LMNA P02545 2/20 0.61
HPGD P15428 2/20 0.61
HTT P42858 1/20 0.61
GAA P10253 1/20 0.56
USP2 O75604 1/20 0.52
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CA12 O43570 2/20 0.51
CA9 Q16790 2/20 0.51
CA2 P00918 1/20 0.51
ALOX15 P16050 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
ATM Q13315 1/20 0.50

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
SCHEMBL1395612 0.93 ALDH1A1 (0.72) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL18894208 0.89 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL8048430 0.87 ALDH1A1 (0.96) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL9066249 0.87 ALDH1A1 (0.96) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL18221849 0.84 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL16503455 0.84 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL12169334 0.83 ALDH1A1 (0.87) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL7776599 0.81 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL439077 0.81 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL29316529 0.81 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ALMNAHPGD

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-8546299-B2 Color-developing composition and recording material containing the same NIPPON SODA CO., LTD. (JP) 2013-10-01 US disclosed
US-20110104619-A1 COLOR-DEVELOPING COMPOSITION AND RECORDING MATERIAL CONTAINING THE SAME NIPPON SODA CO., LTD. (JP) 2011-05-05 US disclosed
EP-2289704-A1 COLOR-DEVELOPING COMPOSITION AND RECORDING MATERIAL CONTAINING THE SAME Nippon Soda Co., Ltd. (JP) 2011-03-02 EP disclosed