SCHEMBL5120134

SCHEMBL5120134

COc1ccc(CNC(=O)C2=NOC3(CCN(C(=S)Nc4cc(C(F)(F)F)cc(C(F)(F)F)c4)CC3)C2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 2/20 0.47
HCRTR1 O43613 1/20 0.41
HCRTR2 O43614 1/20 0.41
KMT2A Q03164 3/20 0.40
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
NAMPT P43490 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.39
AKR1C3 P42330 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
MEN1 O00255 2/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 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
SCHEMBL5118862 0.88 SMN1; SMN2 (0.47) SMN1; SMN2LMNAKMT2APDGFRBPDGFRA
SCHEMBL1457699 0.88 SMN1; SMN2 (0.46) SMN1; SMN2LMNAHCRTR1HCRTR2KMT2A
SCHEMBL5115065 0.88 MEN1 (0.43) SMN1; SMN2LMNAHCRTR1KMT2ANAMPT
SCHEMBL5121677 0.87 LMNA (0.41) SMN1; SMN2LMNAKMT2APDGFRBPDGFRA
SCHEMBL1457155 0.87 NAMPT (0.51) SMN1; SMN2LMNAKMT2ANAMPTMAPT
SCHEMBL5126307 0.86 MAPT (0.41) KMT2AMAPTHTTGPR119MEN1
SCHEMBL5114017 0.85 PDGFRB (0.44) SMN1; SMN2KMT2APDGFRBPDGFRANAMPT
SCHEMBL5127389 0.85 PDGFRB (0.44) SMN1; SMN2LMNAHCRTR1HCRTR2KMT2A
SCHEMBL5119733 0.84 KMT2A (0.46) SMN1; SMN2KMT2APDGFRBPDGFRANAMPT
SCHEMBL5125610 0.84 ALDH1A1 (0.47) SMN1; SMN2LMNAKMT2APDGFRBPDGFRA

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 SMN1; SMN2 4677/4885LMNA 421/4885HCRTR1 3437/4885

“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.