SCHEMBL18181978

SCHEMBL18181978

CCC(=O)Oc1ccccc1COc1cc(F)c(CC)cc1CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.41
PARP14 Q460N5 1/20 0.41
ACLY P53396 1/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.37
MCL1 Q07820 1/20 0.37
AKR1C3 P42330 1/20 0.37
SLC1A5 Q15758 1/20 0.37
MAOB P27338 1/20 0.36

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
SCHEMBL18183029 0.92 PARP10 (0.41) PARP10PARP14ACLYALDH1A1LMNA
SCHEMBL18156115 0.90 PTGDR2 (0.43) PARP10PARP14ACLYALDH1A1LMNA
SCHEMBL18178586 0.90 PTGDR2 (0.40) PARP10PARP14ACLYALDH1A1LMNA
SCHEMBL18181999 0.89 ALDH1A1 (0.40) PARP10PARP14ACLYALDH1A1LMNA
SCHEMBL18156247 0.89 TP53 (0.40) PARP10PARP14ACLYMEN1MAPT
SCHEMBL18182488 0.89 PARP10 (0.43) PARP10PARP14ALDH1A1LMNAMEN1
SCHEMBL18183010 0.88 ACLY (0.39) PARP10PARP14ACLYALDH1A1LMNA
SCHEMBL18156497 0.88 ACLY (0.36) ACLYALDH1A1LMNAMEN1MAPT
SCHEMBL18156281 0.87 FFAR1 (0.40) PARP10PARP14ACLYMAOBFFAR4
SCHEMBL18182890 0.86 PTGDR2 (0.43) LMNAMAPTHPGDALOX15MAPK1

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 2903/4885ACLY 1774/4885

“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.