SCHEMBL6256544

SCHEMBL6256544

O=C1COCc2ccc(-c3ccccc3)nc21

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
RAB9A P51151 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPT P10636 3/20 0.37
CYP1A2 P05177 2/20 0.37
THRB P10828 1/20 0.36
MAP2K3 P46734 1/20 0.34
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
ASIC3 Q9UHC3 1/20 0.33
FEN1 P39748 1/20 0.33
XDH P47989 1/20 0.33

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
SCHEMBL883086 0.79 KMT2A (0.53) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL31009554 0.78 KMT2A (0.44) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL3222113 0.76 RAB9A (0.43) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL10271343 0.75 KMT2A (0.49) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL19153125 0.73 S100A4 (0.39) RAB9AL3MBTL1KDM4EMAPT
SCHEMBL6256784 0.71 MEN1 (0.38) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL27708952 0.69 CLK4 (0.49) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL31460555 0.66 RAB9A (0.48) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL10473024 0.66 RAB9A (0.43) KMT2AMEN1RAB9AL3MBTL1ALDH1A1
SCHEMBL17875905 0.65 CYP19A1 (0.40) KMT2AMEN1RAB9AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0752421-B1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ASTRAZENECA AB (SE) 2005-10-12 EP disclosed
US-6787562-B2 ANALGESICS; OSTEOPOROSIS ZENECA LTD. (GB) 2004-09-07 US disclosed
US-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists SYNGENTA LIMITED (GB) 2003-07-24 US disclosed
US-6057345-A ANTAGONISTS OF THE PAIN ENHANCING EFFECTS OF E-TYPE PROSTAGLANDINS; USED IN PAIN RELIEF ZENECA LIMITED (GB) 2000-05-02 US disclosed
EP-0752421-A1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ZENECA LIMITED (GB) 1997-01-08 EP 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-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists PTGER1, PTGDR, PTGER2 KMT2A 4150/4885MEN1 4474/4885RAB9A 2473/4885

“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.