SCHEMBL8967770

SCHEMBL8967770

Oc1cccc(C=Cc2ccccc2Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.59
LCK P06239 2/20 0.58
RELA Q04206 2/20 0.52
MMP1 P03956 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
MAPT P10636 1/20 0.52
PKM P14618 1/20 0.52
NFKB1 P19838 1/20 0.52
MAOB P27338 1/20 0.52
RAB9A P51151 1/20 0.52
NFKB2 Q00653 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NFE2L2 Q16236 1/20 0.51
CHAT P28329 1/20 0.49
ABL1 P00519 1/20 0.49
BCR P11274 1/20 0.49

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
SCHEMBL8967768 1.00 TTR (0.59) TTRLCKRELAMMP1MMP2
SCHEMBL9419865 0.81 TRPA1 (0.68) TTRLCKMMP1MMP2MMP9
SCHEMBL699005 0.81 CHAT (0.51) TTRRELAMAPTMAOBNFE2L2
SCHEMBL699004 0.81 CHAT (0.51) TTRRELAMAPTMAOBNFE2L2
SCHEMBL9419867 0.81 TRPA1 (0.68) TTRLCKMMP1MMP2MMP9
SCHEMBL2512334 0.80 LCK (0.86) LCKMEN1NPC1MAOBKMT2A
SCHEMBL2512336 0.80 LCK (0.86) LCKMEN1NPC1MAOBKMT2A
SCHEMBL13338339 0.80 LCK (0.86) LCKMEN1NPC1MAOBKMT2A
SCHEMBL6120528 0.79 CHAT (0.49) TTRRELAMEN1NPC1MAPT
SCHEMBL6120530 0.79 CHAT (0.49) TTRRELAMEN1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5530030-A CHLORINATED HYDROXYSTILBENES KIORITZ CORPORATIN (JP) 1996-06-25 US claimed
US-5530030-A CHLORINATED HYDROXYSTILBENES KIORITZ CORPORATIN (JP) 1996-06-25 US disclosed