SCHEMBL18178074

SCHEMBL18178074

CCc1cccc(OC(=O)OC)c1COc1ccc(C)cc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 3/20 0.44
LMNA P02545 3/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
KDM4E B2RXH2 6/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 2/20 0.42
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.40
HTT P42858 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
SCHEMBL18178076 0.92 LMNA (0.44) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178155 0.91 MAPT (0.43) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178464 0.90 HPGD (0.44) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178168 0.90 KDM4E (0.45) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178067 0.90 L3MBTL1 (0.47) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18182803 0.89 CYP1A2 (0.44) MAPTHPGDTDP1SMN1; SMN2NPC1
SCHEMBL18178063 0.89 MAPT (0.52) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178073 0.88 L3MBTL1 (0.46) L3MBTL1MAPTHPGDLMNAMAPK1
SCHEMBL18178162 0.88 MRGPRX4 (0.47) L3MBTL1MAPTHPGDLMNATDP1
SCHEMBL18178372 0.87 CD274 (0.38) L3MBTL1MAPTHPGDLMNATDP1

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-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 L3MBTL1 401/4885MAPT 4572/4885HPGD 4638/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.