SCHEMBL5425145

SCHEMBL5425145

O=C1N(c2ccccc2)CCC12CCCN(S(=O)(=O)c1ccccc1C(F)(F)F)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
LIPE Q05469 4/20 0.48
NR3C1 P04150 1/20 0.46
EGLN1 Q9GZT9 1/20 0.43
CHRM4 P08173 1/20 0.41
TP53 P04637 1/20 0.40
MDM2 Q00987 1/20 0.40
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DCTPP1 Q9H773 1/20 0.39
GBA1 P04062 1/20 0.39
TSHR P16473 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL5426140 0.85 NPSR1 (0.46) KMT2AMEN1LIPEALDH1A1L3MBTL1
SCHEMBL5426894 0.84 LIPE (0.55) LIPEALDH1A1TSHRUSP2CYP1A2
SCHEMBL5428089 0.83 CTSG (0.48) LIPEEGLN1ALDH1A1DCTPP1TSHR
SCHEMBL5427248 0.83 LIPE (0.58) LIPEEGLN1CHRM4ALDH1A1TSHR
SCHEMBL5427031 0.83 CYP3A4 (0.55) KMT2AMEN1ALDH1A1L3MBTL1TSHR
SCHEMBL5425005 0.81 LIPE (0.41) LIPEEGLN1ALDH1A1TSHRUSP2
SCHEMBL5418572 0.80 NR3C1 (0.46) LIPENR3C1ALDH1A1L3MBTL1GBA1
SCHEMBL5425158 0.80 PKM (0.46) LIPEALDH1A1TSHRUSP2CYP1A2
SCHEMBL5428161 0.80 SPR (0.42) LIPEALDH1A1GBA1TSHRUSP2
SCHEMBL5423716 0.80 NPC1 (0.46) LIPEALDH1A1TSHRUSP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 KMT2A 2691/4885MEN1 995/4885LIPE 3897/4885

“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.