SCHEMBL7599228

SCHEMBL7599228

COc1ccc(N(S)C(=O)NCCCCOC(=O)c2cccc(NC(=O)NS(=O)(=O)c3ccc(C)cc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TCF4 P15884 2/20 0.43
CTNNB1 P35222 2/20 0.43
MAPT P10636 4/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
PPARG P37231 1/20 0.40
RAB9A P51151 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL7600363 0.98 TCF4 (0.44) TCF4CTNNB1MAPTALDH1A1GAA
SCHEMBL7599432 0.95 LMNA (0.44) TCF4CTNNB1MAPTALDH1A1LMNA
SCHEMBL7600651 0.92 LMNA (0.48) TCF4CTNNB1ALDH1A1LMNATSHR
SCHEMBL7600400 0.91 MAPT (0.49) MAPTALDH1A1GAAKDM4ELMNA
SCHEMBL7596599 0.90 LMNA (0.48) TCF4CTNNB1ALDH1A1LMNATSHR
SCHEMBL7597922 0.88 MAPT (0.49) MAPTALDH1A1GAAKDM4EHSD17B10
SCHEMBL7601301 0.87 LMNA (0.46) TCF4CTNNB1MAPTALDH1A1LMNA
SCHEMBL7598568 0.86 LMNA (0.50) TCF4CTNNB1MAPTALDH1A1GAA
SCHEMBL7597925 0.86 LMNA (0.45) TCF4CTNNB1MAPTALDH1A1LMNA
SCHEMBL7597457 0.86 LMNA (0.44) TCF4CTNNB1MAPTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed