SCHEMBL6208697

SCHEMBL6208697

COc1ccc(CC(=O)c2ccc(OCc3ccccc3)cc2)cn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
PABPC1 P11940 1/20 0.64
L3MBTL1 Q9Y468 2/20 0.61
MAOB P27338 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
RAB9A P51151 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HTT P42858 2/20 0.53
MAPT P10636 2/20 0.53
GAA P10253 1/20 0.53
NR4A1 P22736 1/20 0.52
NR4A2 P43354 1/20 0.52
NR4A3 Q92570 1/20 0.52
NPC1 O15118 2/20 0.52
POLB P06746 1/20 0.52
EGFR P00533 2/20 0.52
PARP10 Q53GL7 1/20 0.50
ALOX5 P09917 1/20 0.49
SRD5A2 P31213 1/20 0.49

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
SCHEMBL6209306 0.93 MEN1 (0.64) MEN1KMT2APABPC1L3MBTL1MAOB
SCHEMBL6818113 0.87 KMT2A (0.53) MEN1KMT2APABPC1MAOBSMN1; SMN2
SCHEMBL6208448 0.86 NPC1 (0.57) KMT2ASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL1419819 0.84 L3MBTL1 (0.70) L3MBTL1MAOBSMN1; SMN2RAB9AALDH1A1
SCHEMBL6208174 0.84 L3MBTL1 (0.70) L3MBTL1MAOBSMN1; SMN2RAB9AALDH1A1
SCHEMBL4220632 0.81 NR4A1 (0.72) L3MBTL1MAOBSMN1; SMN2RAB9AALDH1A1
SCHEMBL6208078 0.80 MEN1 (0.60) MEN1KMT2APABPC1MAOB
SCHEMBL9950591 0.78 MEN1 (0.63) MEN1KMT2APABPC1L3MBTL1MAOB
SCHEMBL5183041 0.78 MEN1 (0.56) MEN1KMT2APABPC1MAOBNPC1
SCHEMBL20349622 0.78 ALDH1A1 (0.59) MEN1KMT2APABPC1L3MBTL1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583749-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE Astellas Pharma Inc. (JP) 2005-10-12 EP disclosed
US-20040157891-A1 Inhibitor of cox FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed
WO-2004065374-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE ASTELLAS PHARMA INC. (JP) 2004-08-05 WO 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-20040157891-A1 Inhibitor of cox PTGS1, PTGS2, PTGES2 MEN1 4420/4885KMT2A 3081/4885PABPC1 2765/4885

“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.