SCHEMBL4627337

SCHEMBL4627337

O=C(O)C1CC(Cl)Oc2ccc(Cl)cc21

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CDC25B P30305 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
AKR1B1 P15121 1/20 0.36
HRH2 P25021 1/20 0.36
HCRTR2 O43614 1/20 0.35
NOTUM Q6P988 2/20 0.35
PIK3CG P48736 1/20 0.34
AR P10275 1/20 0.34
MAPKAPK2 P49137 1/20 0.34

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
SCHEMBL10900755 0.76 HCRTR2 (0.49) CDC25BHCRTR2
SCHEMBL27833999 0.76 CYP3A4 (0.41) ALOX15HSD17B10PTGS1PTGS2
SCHEMBL1846189 0.74 MAP3K14 (0.50)
SCHEMBL29590701 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL22614278 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL29159681 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL22614669 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL22613932 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL11523396 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1
SCHEMBL29499473 0.73 POLB (0.47) POLBCDC25BPTGS1PTGS2AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312322-A1 Organic Compounds NOVARTIS AG (CH) 2008-12-18 US claimed
EP-1888505-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2008-02-20 EP claimed
WO-2006125593-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-11-30 WO claimed
US-20080312322-A1 Organic Compounds NOVARTIS AG (CH) 2008-12-18 US disclosed
EP-1888505-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2008-02-20 EP disclosed
WO-2006125593-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-11-30 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-20080312322-A1 Organic Compounds NR3C2, MRGPRX2, HRH2 POLB 2635/4885ALOX15 436/4885HSD17B10 2507/4885

“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.