SCHEMBL365735

SCHEMBL365735

CCCC(CC(=O)c1ccc(OC)nc1)c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.44
GPR183 P32249 8/20 0.43
KCNH2 Q12809 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
MAPT P10636 1/20 0.37
GRIN2B Q13224 1/20 0.37
GABRA1 P14867 1/20 0.36
OXTR P30559 1/20 0.36
KMT2A Q03164 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
SCHEMBL363535 0.93 GPR183 (0.42) NNMTGPR183KCNH2L3MBTL1MKNK1
SCHEMBL362792 0.86 NNMT (0.44) NNMTGPR183KCNH2L3MBTL1MKNK1
SCHEMBL1390121 0.86 GPR183 (0.40) NNMTGPR183KCNH2L3MBTL1
SCHEMBL362565 0.85 GPR183 (0.44) NNMTGPR183KCNH2L3MBTL1MKNK1
SCHEMBL363530 0.83 NNMT (0.39) NNMTGPR183KCNH2MKNK1MKNK2
SCHEMBL1390215 0.78 CTSA (0.45) NNMTGPR183KCNH2L3MBTL1MAPT
SCHEMBL1390214 0.78 CTSA (0.45) NNMTGPR183KCNH2L3MBTL1MAPT
SCHEMBL1390664 0.78 CTSA (0.45) NNMTGPR183KCNH2L3MBTL1MAPT
SCHEMBL370520 0.76 GPR183 (0.44) NNMTGPR183KCNH2GRIN2B
SCHEMBL369181 0.76 GPR183 (0.44) NNMTGPR183KCNH2MKNK1MKNK2

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-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP disclosed
US-8765730-B2 1-hydroxyimino-3-phenyl-propanes Hoffmann-La Roche Inc (US) 2014-07-01 US disclosed
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed
US-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-12 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-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES GPBAR1, GPR119, ADRB1 NNMT 3132/4885GPR183 80/4885KCNH2 1276/4885

“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.