SCHEMBL18178346

SCHEMBL18178346

COC(=O)Oc1ccccc1COc1cc(C)c(C)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.44
PARP14 Q460N5 1/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MCL1 Q07820 1/20 0.40
LMNA P02545 4/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
PARP15 Q460N3 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL18178116 0.94 PARP10 (0.43) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18182377 0.91 PARP10 (0.41) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18178244 0.90 PTGDR2 (0.44) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18178375 0.88 PTGDR2 (0.47) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18178739 0.87 PTGDR2 (0.42) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18178177 0.86 PTGDR2 (0.44) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18182941 0.86 PARP10 (0.43) PARP10PARP14HPGDKDM4EHSD17B10
SCHEMBL18178111 0.86 MRGPRX4 (0.50) PARP10PARP14HPGDKDM4EHSD17B10
SCHEMBL18178386 0.86 PTGDR2 (0.43) PARP10PARP14PTGDR2HPGDKDM4E
SCHEMBL18178348 0.85 MRGPRX4 (0.38) PARP10PARP14HPGDKDM4EHSD17B10

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 PARP10 2802/4885PARP14 2903/4885PTGDR2 4455/4885

“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.