SCHEMBL5127745

SCHEMBL5127745

O=C(NCc1ccc(Cl)cc1)C1=NOC2(CCN(C(=S)Nc3ccccc3C(F)(F)F)CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.45
KMT2A Q03164 6/20 0.45
SMN1; SMN2 Q16637 4/20 0.43
HTT P42858 3/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PKM P14618 1/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 3/20 0.38
KDM4E B2RXH2 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
SCHEMBL5121165 0.90 GAA (0.47) LMNAKMT2ASMN1; SMN2HTTALDH1A1
SCHEMBL5119573 0.88 KMT2A (0.39) KMT2ASMN1; SMN2HTTALDH1A1GAA
SCHEMBL5119685 0.87 RAB9A (0.39) LMNAKMT2ASMN1; SMN2HTTMAPT
SCHEMBL1457213 0.86 KMT2A (0.43) LMNAKMT2ASMN1; SMN2HTTMAPT
SCHEMBL5122782 0.86 MEN1 (0.47) LMNAKMT2ASMN1; SMN2HTTMAPT
SCHEMBL5121677 0.86 LMNA (0.41) LMNAKMT2ASMN1; SMN2HTTMAPT
SCHEMBL5126307 0.85 MAPT (0.41) KMT2AHTTMAPTMEN1KDM4E
SCHEMBL5111849 0.85 MAPT (0.52) LMNAKMT2AHTTMAPTALDH1A1
SCHEMBL5111409 0.83 POLB (0.49) LMNAKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL5119238 0.82 ALDH1A1 (0.46) LMNAKMT2ASMN1; SMN2HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214807-A1 Substituted Spiro Compounds and their Use for Producing Drugs GRUENENTHAL GMBH (DE) 2008-09-04 US claimed
US-20080214807-A1 Substituted Spiro Compounds and their Use for Producing Drugs GRUENENTHAL GMBH (DE) 2008-09-04 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-20080214807-A1 Substituted Spiro Compounds and their Use for Producing Drugs REN, PKD1, NR3C2 LMNA 421/4885KMT2A 4068/4885SMN1; SMN2 4677/4885

“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.