SCHEMBL21024846

SCHEMBL21024846

Cc1ccc(/C=C/C(=O)Nc2cc3ccccc3cc2C)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 8/20 0.55
MMP2 P08253 8/20 0.55
MMP9 P14780 8/20 0.55
EGFR P00533 1/20 0.52
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
KDM4E B2RXH2 4/20 0.48
KDM1A O60341 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HSP90AA1 P07900 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL15397006 0.87 MAPT (0.55) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL111461 0.85 MMP1 (0.75) MMP1MMP2MMP9EGFRMAOA
SCHEMBL13352267 0.84 MEN1 (0.66) MMP1MMP2MMP9KDM4EKDM1A
SCHEMBL111222 0.81 MMP1 (0.59) MMP1MMP2MMP9EGFR
SCHEMBL15396446 0.80 MMP1 (0.67) MMP1MMP2MMP9EGFRMAOA
SCHEMBL110012 0.80 MEN1 (0.68) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL2779401 0.80 MEN1 (0.68) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL111095 0.79 SMN1; SMN2 (0.74) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL16272298 0.78 MMP1 (0.55) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL15396755 0.78 MMP1 (0.55) MMP1MMP2MMP9EGFRKDM4E

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-3485883-A1 METHODS OF TREATING EYE DISEASES ASSOCIATED WITH INFLAMMATION AND VASCULAR PROLIFERATION OccuRx Pty Ltd (AU) 2019-05-22 EP disclosed