SCHEMBL4082498

SCHEMBL4082498

COC(=O)COc1ccccc1CBr

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.53
ALDH1A1 P00352 3/20 0.48
MCL1 Q07820 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.45
POLB P06746 2/20 0.45
HSD17B10 Q99714 2/20 0.44
TSHR P16473 2/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL10193137 0.86 PPARD (0.59) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL10422938 0.85 PPARD (0.55) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL8633156 0.84 KDM4E (0.47) PPARDALDH1A1HTTL3MBTL1LMNA
SCHEMBL7235182 0.84 USP2 (0.56) ALDH1A1SMN1; SMN2L3MBTL1NPSR1LMNA
SCHEMBL10506317 0.84 SMN1; SMN2 (0.60) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL7001693 0.83 PPARD (0.53) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL6587328 0.83 PPARD (0.53) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL7335064 0.82 PPARD (0.75) PPARDALDH1A1MCL1L3MBTL1MEN1
SCHEMBL8882060 0.82 L3MBTL1 (0.71) PPARDALDH1A1MCL1SMN1; SMN2HTT
SCHEMBL2798208 0.81 HTT (0.59) SMN1; SMN2HTTL3MBTL1NPSR1KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1847533-B1 SIX-MEMBERED HETEROCYCLIC COMPOUND AND THE USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2013-08-14 EP disclosed
US-7531533-B2 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-05-12 US disclosed
EP-1847533-A1 SIX-MEMBERED HETEROCYCLIC COMPOUND AND THE USE THEREOF Asahi Kasei Pharma Corporation (JP) 2007-10-24 EP disclosed
US-20070060590-A1 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2007-03-15 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-20070060590-A1 6-Membered heterocyclic compound and use thereof WNT1, CYP11B2, CYP11B1 PPARD 1956/4885ALDH1A1 1638/4885MCL1 501/4885

“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.