SCHEMBL18178372

SCHEMBL18178372

CCc1cccc(OC(=O)OC)c1COc1cc(C)c(C)cc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.38
PDCD1 Q15116 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CUL4A Q13619 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ABCG2 Q9UNQ0 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL18182399 0.94 ABCG2 (0.36) CD274PDCD1KDM4EALDH1A1TDP1
SCHEMBL18178370 0.92 CD274 (0.39) CD274PDCD1KDM4EALDH1A1TDP1
SCHEMBL18178272 0.91 MRGPRX4 (0.37) CD274PDCD1KDM4EALDH1A1HPGD
SCHEMBL18178181 0.91 PTGER1 (0.36) CD274PDCD1KDM4EALDH1A1TDP1
SCHEMBL18178373 0.91 CD274 (0.37) CD274PDCD1KDM4EALDH1A1TDP1
SCHEMBL18178753 0.89 ACHE (0.38) CD274PDCD1KDM4EALDH1A1TDP1
SCHEMBL18178366 0.89 CUL4A (0.38) CD274PDCD1KDM4EALDH1A1CUL4A
SCHEMBL18178384 0.89 MAPT (0.43) CD274KDM4EALDH1A1FFAR4HPGD
SCHEMBL18178391 0.89 KDM4E (0.38) CD274PDCD1KDM4EALDH1A1HPGD
SCHEMBL18178367 0.89 SLC22A12 (0.41) CD274KDM4EALDH1A1CUL4AMEN1

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 CD274 3579/4885PDCD1 2625/4885KDM4E 2107/4885

“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.