SCHEMBL5423744

SCHEMBL5423744

O=C1N(c2ccc(Cl)cc2)CCC12CCCN(S(=O)(=O)c1ccc(Cl)cc1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
HSD11B1 P28845 2/20 0.46
TSHR P16473 2/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 3/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CTSG P08311 1/20 0.44
CMA1 P23946 1/20 0.44
AKR1C3 P42330 1/20 0.43
LIPE Q05469 1/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
USP2 O75604 1/20 0.42
CYP1A2 P05177 1/20 0.42
HIF1A Q16665 1/20 0.42
ATM Q13315 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL5418595 0.94 HTR7 (0.45) L3MBTL1HSD11B1TSHRKMT2APOLB
SCHEMBL5433869 0.92 POLB (0.43) L3MBTL1HSD11B1TSHRKMT2APOLB
SCHEMBL5425193 0.92 SLC13A5 (0.40) L3MBTL1HSD11B1TSHRKMT2APOLB
SCHEMBL5421695 0.92 USP2 (0.45) L3MBTL1HSD11B1TSHRKMT2APOLB
SCHEMBL5418435 0.92 LMNA (0.51) HSD11B1TSHRKMT2APOLBMEN1
SCHEMBL5438826 0.89 LIPE (0.38) L3MBTL1HSD11B1TSHRKMT2APOLB
SCHEMBL5420449 0.89 LIPE (0.60) KMT2AMEN1LIPE
SCHEMBL5429692 0.89 LIPE (0.46) TSHRKMT2APOLBMEN1LIPE
SCHEMBL5427031 0.85 CYP3A4 (0.55) L3MBTL1TSHRKMT2AMEN1SMN1; SMN2
SCHEMBL5431071 0.85 CYP3A4 (0.46) L3MBTL1TSHRKMT2AMEN1SMN1; SMN2

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
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US claimed
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US disclosed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 L3MBTL1 1548/4885HSD11B1 21/4885TSHR 254/4885

“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.